Boc-hyp-oet (CAS 37813-30-2): price, suppliers and safety

What is Boc-hyp-oet?

Plain description, key identifiers and synonyms

Boc-hyp-oet is a chemical substance with the molecular formula C12H21NO5 and a molar mass of 259.30 g/mol. Its CAS registry number is 37813-30-2. The IUPAC name is 1-O-tert-butyl 2-O-ethyl (2S,4R)-4-hydroxypyrrolidine-1,2-dicarboxylate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name: 1-O-tert-butyl 2-O-ethyl (2S,4R)-4-hydroxypyrrolidine-1,2-dicarboxylate
CAS number: 37813-30-2
Molecular formula: C₁₂H₂₁NO₅
MDL number: MFCD09264314
InChIKey: MNMDZSAWTQOEHX-BDAKNGLRSA-N
InChI: InChI=1S/C12H21NO5/c1-5-17-10(15)9-6-8(14)7-13(9)11(16)18-12(2,3)4/h8-9,14H,5-7H2,1-4H3/t8-,9+/m1/s1
Canonical SMILES: CCOC(=O)C1CC(O)CN1C(=O)OC(C)(C)C
Isomeric SMILES: CCOC(=O)[C@@H]1C[C@H](CN1C(=O)OC(C)(C)C)O

Synonyms

(2S,4R)-1-tert-Butyl 2-ethyl 4-hydroxypyrrolidine-1,2-dicarboxylate
1-tert-butoxycarbonyl-4-hydroxy-L-proline ethyl ester
1-O-tert-butyl 2-O-ethyl (2S,4R)-4-hydroxypyrrolidine-1,2-dicarboxylate
1-Boc-L-hydroxyproline ethyl ester
(2S,4R)-1-Boc-4-hydroxypyrrolidine-2-carboxylic acid ethyl ester
1-tert-butyl 2-ethyl (2S,4R)-4-hydroxypyrrolidine-1,2-dicarboxylate
1-tert-Butoxycarbonyl 4-hydroxy-L-proline ethyl ester
(4R)-1-Boc-4-hydroxy-L-proline ethyl ester
1-(tert-butyl) 2-ethyl (2S,4R)-4-hydroxypyrrolidine-1,2-dicarboxylate
1-Boc-4-hydroxy-l-proline ethyl ester
Boc-L-Hydroxy-Proline Ethyl Ester
(2S,4R)-4-Hydroxy-1,2-pyrrolidinedicarboxylic acid 1-tert-butyl 2-ethyl ester
Ethyl (2S,4R)-1-Boc-4-Hydroxypyrrolidine-2-carboxylate
n-(tert-butoxycarbonyl)-trans-4-hydroxy-l-proline ethyl ester
(2S,4R)-1-(t-butoxycarbonyl)-2-ethoxycarbonyl -4-hydroxypyrrolidine
O1-tert-butyl O2-ethyl (2S,4R)-4-hydroxypyrrolidine-1,2-dicarboxylate
(2S)-4-hydroxypyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-ethyl ester
(2S, 4R)-4-hydroxypyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester 2-ethyl ester
(2S,4R) 4-hydroxy-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester 2-ethyl ester
(2S,4R)-4-hydroxy-pyrrolidine-1,2-dicarboxylic acid-1-tert-butyl ester-2-ethyl ester
(2S,4R)-4-hydroxypyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester 2-ethyl ester

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight	259.30 g/molcalc.
Exact mass	259.142 Dacalc.
LogP (octanol/water)	0.92calc.
Topological polar surface area	76.07 Å²calc.
Hydrogen bond donors	1calc.
Hydrogen bond acceptors	5calc.
Rotatable bonds	2calc.
Heavy atoms	18calc.
Rings	1calc.
Aromatic rings	0calc.
Fraction sp3 carbons	0.83calc.
Formal charge	0calc.
Stereocentres	2calc.
Lipinski rule of five	Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

C1CCNC1

1 ring, 5 atoms, the Pyrrolidine ring system.

22,348 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Boc-hyp-oet suppliers

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Boc-hyp-oet price

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Uses and applications

What the substance is used for, by industry and function

Industries and functions

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Boc-hyp-oet is traded under.

HS 2933.99Indicative HS code

Heterocyclic compounds with nitrogen hetero-atom(s) only, other

World exports in 2024

$12.1B

−31.0% vs 2023, imports $28.8B

2019 to 2024

Top exporters

China30.5%
India * partner reported16.3%
Ireland9.0%

Top importers

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Boc-hyp-oet is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Parent and salt forms, stereoisomers, similar structures and isomers

Stereoisomers and isotopic forms

Same connectivity, different stereochemistry or isotopes (same InChIKey skeleton)

(4R)-4-Hydroxy-1-Boc-D-proline ethyl ester chemical structure, C12H21NO5, CAS 77450-00-1

(4R)-4-Hydroxy-1-Boc-D-proline ethyl ester77450-00-1C₁₂H₂₁NO₅

(2S)-1-tert-Butyl 2-ethyl 4-hydroxypyrrolidine-1,2-dicarboxylate chemical structure, C12H21NO5, CAS 200129-53-9

(2S)-1-tert-Butyl 2-ethyl 4-hydroxypyrrolidine-1,2-dicarboxylate200129-53-9C₁₂H₂₁NO₅

Similar structures

Nearest neighbours by Morgan fingerprint Tanimoto similarity

(2S,4R)-1-tert-Butyl 2-ethyl 4-aminopyrrolidine-1,2-dicarboxylate chemical structure, C12H22N2O4, CAS 871014-58-3

1-(tert-Butyl) 2-ethyl (2S,4S)-4-aminopyrrolidine-1,2-dicarboxylate chemical structure, C12H22N2O4, CAS 511242-54-9

(2S,4S)-1-Boc-4-methylpyrrolidine-2-carboxylic acid ethyl ester chemical structure, C13H23NO4, CAS 1419388-15-0

Ethyl (2R,4R)-1-boc-4-methylpyrrolidine-2-carboxylate chemical structure, C13H23NO4, CAS 165273-03-0

1-tert-Butyl 2-chloromethyl (2R,4R)-4-hydroxypyrrolidine-1,2-dicarboxylate chemical structure, C11H18ClNO5, CAS 2137062-06-5

1-tert-Butyl 2-chloromethyl (2R,4S)-4-hydroxypyrrolidine-1,2-dicarboxylate chemical structure, C11H18ClNO5, CAS 2137026-11-8

1-tert-Butyl 2-chloromethyl (2S,4S)-4-hydroxypyrrolidine-1,2-dicarboxylate chemical structure, C11H18ClNO5, CAS 2137032-74-5

1-tert-Butyl 2-ethyl 5-hydroxypiperidine-1,2-dicarboxylate chemical structure, C13H23NO5, CAS 1785721-13-2

(2S,5S)-1-tert-Butyl 2-ethyl 5-hydroxypiperidine-1,2-dicarboxylate chemical structure, C13H23NO5, CAS 1463501-44-1

O1-tert-butyl O2-ethyl cis-5-hydroxypiperidine-1,2-dicarboxylate chemical structure, C13H23NO5, CAS 869658-84-4

Same formula isomers

Different compounds that share this molecular formula

All isomers

Celgosivir chemical structure, C12H21NO5, CAS 121104-96-9

Celgosivir121104-96-9C₁₂H₂₁NO₅

2-((1-((tert-Butoxy)carbonyl)piperidin-4-yl)oxy)acetic acid chemical structure, C12H21NO5, CAS 161948-70-5

2-((1-((tert-Butoxy)carbonyl)piperidin-4-yl)oxy)acetic acid161948-70-5C₁₂H₂₁NO₅3 suppliers

2-(((tert-Butoxy)carbonyl)amino)-2-(oxan-4-yl)acetic acid chemical structure, C12H21NO5, CAS 182287-49-6

2-(((tert-Butoxy)carbonyl)amino)-2-(oxan-4-yl)acetic acid182287-49-6C₁₂H₂₁NO₅2 suppliers

Methyl (2S,4R)-4-hydroxypiperidine-2-carboxylate, N-BOC protected chemical structure, C12H21NO5, CAS 254882-06-9

Methyl (2S,4R)-4-hydroxypiperidine-2-carboxylate, N-BOC protected254882-06-9C₁₂H₂₁NO₅

3-tert-Butyl 4-methyl (4R)-2,2-dimethyl-1,3-oxazolidine-3,4-dicarboxylate chemical structure, C12H21NO5, CAS 95715-86-9

3-tert-Butyl 4-methyl (4R)-2,2-dimethyl-1,3-oxazolidine-3,4-dicarboxylate95715-86-9C₁₂H₂₁NO₅

3-tert-Butyl 4-methyl (4S)-2,2-dimethyl-1,3-oxazolidine-3,4-dicarboxylate chemical structure, C12H21NO5, CAS 108149-60-6

3-tert-Butyl 4-methyl (4S)-2,2-dimethyl-1,3-oxazolidine-3,4-dicarboxylate108149-60-6C₁₂H₂₁NO₅

Methyl 1-{[(tert-butoxy)carbonyl]amino}-3-(hydroxymethyl)cyclobutane-1-carboxylate chemical structure, C12H21NO5, CAS 191110-93-7

Methyl 1-{[(tert-butoxy)carbonyl]amino}-3-(hydroxymethyl)cyclobutane-1-carboxylate191110-93-7C₁₂H₂₁NO₅

2-({1-[(tert-Butoxy)carbonyl]piperidin-3-yl}oxy)acetic acid chemical structure, C12H21NO5, CAS 231622-09-6

2-({1-[(tert-Butoxy)carbonyl]piperidin-3-yl}oxy)acetic acid231622-09-6C₁₂H₂₁NO₅

1,2-Pyrrolidinedicarboxylic acid, 4-(methoxymethyl)-, 1-(1,1-dimethylethyl) ester, (2S,4S)- chemical structure, C12H21NO5, CAS 1378388-16-9

1,2-Pyrrolidinedicarboxylic acid, 4-(methoxymethyl)-, 1-(1,1-dimethylethyl) ester, (2S,4S)-1378388-16-9C₁₂H₂₁NO₅6 suppliers

4-({[(tert-Butoxy)carbonyl]amino}methyl)oxane-4-carboxylic acid chemical structure, C12H21NO5, CAS 946761-11-1

4-({[(tert-Butoxy)carbonyl]amino}methyl)oxane-4-carboxylic acid946761-11-1C₁₂H₂₁NO₅

1-tert-Butyl 3-methyl 5-hydroxypiperidine-1,3-dicarboxylate chemical structure, C12H21NO5, CAS 1095010-47-1

1-tert-Butyl 3-methyl 5-hydroxypiperidine-1,3-dicarboxylate1095010-47-1C₁₂H₂₁NO₅

2-(4-(((tert-Butoxy)carbonyl)amino)oxan-4-yl)acetic acid chemical structure, C12H21NO5, CAS 946682-30-0

2-(4-(((tert-Butoxy)carbonyl)amino)oxan-4-yl)acetic acid946682-30-0C₁₂H₂₁NO₅

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Boc-hyp-oet

Key facts

What is Boc-hyp-oet?

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Physical and chemical properties

Physical and chemical properties

Computed descriptors

Murcko scaffold

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Key facts

What is Boc-hyp-oet?

Identifiers

Synonyms

Physical and chemical properties

Physical and chemical properties

Computed descriptors

Murcko scaffold

Safety and hazards

Boc-hyp-oet suppliers

Where suppliers are based

Send one request to many suppliers

Boc-hyp-oet price

Uses and applications

Industries and functions

Regulatory status

HS code and trade data

Global trade

Related chemicals

Stereoisomers and isotopic forms

Similar structures

Same formula isomers

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