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Home > Encyclopedia > Ethyl (3S)-4-chloro-3-hydroxybutanoate

Ethyl (3S)-4-chloro-3-hydroxybutanoate

Ethyl (3S)-4-chloro-3-hydroxybutanoate structure

Ethyl (3S)-4-chloro-3-hydroxybutanoate 

structure
  • CAS No:

    86728-85-0

  • Formula:

    C6H11ClO3

  • Chemical Name:

    Ethyl (3S)-4-chloro-3-hydroxybutanoate

  • Synonyms:

    Butanoic acid,4-chloro-3-hydroxy-,ethyl ester,(3S)-;Butanoic acid,4-chloro-3-hydroxy-,ethyl ester,(S)-;Ethyl (3S)-4-chloro-3-hydroxybutanoate;Ethyl (S)-γ-chloro-β-hydroxybutyrate;Ethyl (3S)-4-chloro-3-hydroxybutyrate;Ethyl (S)-4-chloro-3-hydroxybutyrate;(3S)-4-Chloro-3-hydroxybutyric acid ethyl ester;Ethyl (S)-4-chloro-3-hydroxybutanoate;(S)-4-Chloro-3-hydroxybutanoic acid ethyl ester;Ethyl (S)-(+)-4-chloro-3-hydroxybutanoate;(-)-Ethyl 4-chloro-3-hydroxybutyrate;Ethyl (3S)-4-chloro-3-hydroxybutanoate;(-)-Ethyl (s)-4-chloro-3-hydroxybutyrate

  • Categories:

    Active Pharmaceutical Ingredients  >  Hormones and the Endocrine System

Description

Colorless to light yellow liqui

Ethyl (3S)-4-chloro-3-hydroxybutanoate Basic Attributes

166.60300

166.60

DTXSID00427096

2918199090

Characteristics

46.53000

0.4

1.0297 g/cm3 @ Temp: 25.00 °C

95 °C @ Press: 3 Torr

109ºC

1.4515-1.4535

Refrigerator

Safety Information

III

6.1

UN 2810

3

R41

S26-S39

Xi

P280-P305 + P351 + P338

H302-H318

|Danger|H302 (95.56%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P310, P321, P330, P332+P313, P362, and P501|Aggregated GHS information provided by 45 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Ethyl (3S)-4-chloro-3-hydroxybutanoate Use and Manufacturing

Atorvastatin Intermediate

Computed Properties

Molecular Weight:166.60
XLogP3:0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:166.0396719
Monoisotopic Mass:166.0396719
Topological Polar Surface Area:46.5
Heavy Atom Count:10
Complexity:105
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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