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Heterocyclic building blocks

MeLAB

Also known as N-Methyl-1,4-dideoxy-1,4-imino-L-arabinitol, (2S,3S,4S)-2-(hydroxymethyl)-1-methylpyrrolidine-3,4-diol, 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-1-methyl-, (2S,3S,4S)-

CAS 117894-12-9Formula C6H13NO3Molar mass 147.17 g/mol
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MeLAB chemical structure, C6H13NO3, CAS 117894-12-9
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
117894-12-9
Formula
C6H13NO3
Molar mass
147.17 g/mol
HS code
293399
Category
Heterocyclic building blocks

What is MeLAB?

Plain description, key identifiers and synonyms

MeLAB is a chemical substance with the molecular formula C6H13NO3 and a molar mass of 147.17 g/mol. Its CAS registry number is 117894-12-9. The IUPAC name is (2S,3S,4S)-2-(hydroxymethyl)-1-methylpyrrolidine-3,4-diol.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2S,3S,4S)-2-(hydroxymethyl)-1-methylpyrrolidine-3,4-diol
CAS number
117894-12-9 CAS number cross-checked
Molecular formula
C6H13NO3
InChIKey
UBVOJPDDTVFNFJ-ZLUOBGJFSA-N
InChI
InChI=1S/C6H13NO3/c1-7-2-5(9)6(10)4(7)3-8/h4-6,8-10H,2-3H2,1H3/t4-,5-,6-/m0/s1
Canonical SMILES
CN1CC(O)C(O)C1CO
Isomeric SMILES
CN1C[C@@H]([C@H]([C@@H]1CO)O)O

Synonyms

  • N-Methyl-1,4-dideoxy-1,4-imino-L-arabinitol
  • (2S,3S,4S)-2-(hydroxymethyl)-1-methylpyrrolidine-3,4-diol
  • 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-1-methyl-, (2S,3S,4S)-
  • (2S,3S,4S)-2-(hydroxymethyl)-1-methyl-pyrrolidine-3,4-diol
  • (2S, 3S, 4S) -2- (Hydroxymethyl) - 1- methyl- 3, 4- pyrrolidinediol

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
147.17 g/molcalc.
Exact mass
147.0895 Dacalc.
LogP (octanol/water)
-1.99calc.
Topological polar surface area
63.93 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
1calc.
Heavy atoms
10calc.
Rings
1calc.
Aromatic rings
0calc.
Fraction sp3 carbons
1calc.
Formal charge
0calc.
Stereocentres
3calc.
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

Murcko scaffold of this chemical, C1CCNC1

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.

MeLAB suppliers

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MeLAB price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

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 MeLAB 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
  1. China30.5%
  2. India * partner reported16.3%
  3. Ireland9.0%
Top importers
  1. Slovenia31.7%
  2. Italy24.2%
  3. United States5.0%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

Quick answers about MeLAB, based on the data on this page

What is MeLAB?

MeLAB is a chemical substance with the molecular formula C6H13NO3 and a molar mass of 147.17 g/mol. Its CAS registry number is 117894-12-9. The IUPAC name is (2S,3S,4S)-2-(hydroxymethyl)-1-methylpyrrolidine-3,4-diol.

What is the CAS number of MeLAB?

The CAS registry number of MeLAB is 117894-12-9.

What is the molecular formula and weight of MeLAB?

The molecular formula of MeLAB is C6H13NO3 and its molar mass is 147.17 g/mol.

What is MeLAB used for?

Known uses and roles of MeLAB include building blocks in research and laboratory and screening compounds in research and laboratory.

Is MeLAB hazardous?

No GHS hazard classification for MeLAB is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of MeLAB?

MeLAB is usually classified under HS code 293399 (Heterocyclic compounds with nitrogen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy MeLAB?

Post a free request on CompoundList and suppliers of MeLAB will send you quotes. Your contact details stay private until you accept a quote.

What is the price of MeLAB?

Suppliers quote MeLAB on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle MeLAB

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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