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Aromatic building blocks

Sch 5802B

Also known as Sch 5802 B, 2-Ethyl-2-phenylsuccinic acid 2-(diethylamino)ethyl ethyl ester, Phenylaethylbernsteinsaeure-aethyl-diaethyl-aminoaethyl-di-ester

CAS 94755-54-1Formula C20H31NO4Molar mass 349.47 g/mol
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Sch 5802B chemical structure, C20H31NO4, CAS 94755-54-1
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
94755-54-1
Formula
C20H31NO4
Molar mass
349.47 g/mol
HS code
292219
Category
Aromatic building blocks

What is Sch 5802B?

Plain description, key identifiers and synonyms

Sch 5802B is a chemical substance with the molecular formula C20H31NO4 and a molar mass of 349.47 g/mol. Its CAS registry number is 94755-54-1. The IUPAC name is 4-O-[2-(diethylamino)ethyl] 1-O-ethyl 2-ethyl-2-phenylbutanedioate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
4-O-[2-(diethylamino)ethyl] 1-O-ethyl 2-ethyl-2-phenylbutanedioate
CAS number
94755-54-1 CAS number cross-checked
Molecular formula
C20H31NO4
InChIKey
GWAXVRVQRWYZAJ-UHFFFAOYSA-N
InChI
InChI=1S/C20H31NO4/c1-5-20(19(23)24-8-4,17-12-10-9-11-13-17)16-18(22)25-15-14-21(6-2)7-3/h9-13H,5-8,14-16H2,1-4H3
SMILES (canonical and isomeric)
CCC(CC(=O)OCCN(CC)CC)(C1=CC=CC=C1)C(=O)OCC

Synonyms

  • Sch 5802 B
  • 2-Ethyl-2-phenylsuccinic acid 2-(diethylamino)ethyl ethyl ester
  • Phenylaethylbernsteinsaeure-aethyl-diaethyl-aminoaethyl-di-ester
  • Succinic acid, 2-ethyl-2-phenyl-, 4-(2-diethylaminoethyl) 1-ethyl ester
  • 4-[2-(Diethylamino)ethyl] 1-ethyl 2-ethyl-2-phenylbutanedioate

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
349.47 g/molcalc.
Exact mass
349.2253 Dacalc.
LogP (octanol/water)
3.17calc.
Topological polar surface area
55.84 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
11calc.
Heavy atoms
25calc.
Rings
1calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.6calc.
Formal charge
0calc.
Stereocentres
1calc.
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, c1ccccc1

c1ccccc1

1 ring, 6 atoms, the Benzene ring system.

485,677 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.

Sch 5802B suppliers

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Sch 5802B 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 Sch 5802B is traded under.

HS 2922.19Indicative HS code

Amino-alcohols, other than those containing more than one kind of oxygen function, their…

World exports in 2024
$2.2B
−4.7% vs 2023, imports $2.27B
2019 to 2024
Top exporters
  1. China21.7%
  2. Germany17.3%
  3. United States15.6%
Top importers
  1. India * partner reported11.0%
  2. United States9.0%
  3. Germany7.2%

* Partner reported figures, a lower bound.

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

The HS code shown for Sch 5802B is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Sch 5802B, based on the data on this page

What is Sch 5802B?

Sch 5802B is a chemical substance with the molecular formula C20H31NO4 and a molar mass of 349.47 g/mol. Its CAS registry number is 94755-54-1. The IUPAC name is 4-O-[2-(diethylamino)ethyl] 1-O-ethyl 2-ethyl-2-phenylbutanedioate.

What is the CAS number of Sch 5802B?

The CAS registry number of Sch 5802B is 94755-54-1.

What is the molecular formula and weight of Sch 5802B?

The molecular formula of Sch 5802B is C20H31NO4 and its molar mass is 349.47 g/mol.

What is Sch 5802B used for?

Known uses and roles of Sch 5802B include building blocks in research and laboratory.

Is Sch 5802B hazardous?

No GHS hazard classification for Sch 5802B 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 Sch 5802B?

Sch 5802B is usually classified under HS code 292219 (Amino-alcohols, other than those containing more than one kind of oxygen function, their…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Sch 5802B?

Post a free request on CompoundList and suppliers of Sch 5802B will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Sch 5802B?

Suppliers quote Sch 5802B 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 Sch 5802B

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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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