Ethyl (3S)-4-chloro-3-hydroxybutanoate
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Ethyl (3S)-4-chloro-3-hydroxybutanoate
structure -
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CAS No:
86728-85-0
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Formula:
C6H11ClO3
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Chemical Name:
Ethyl (3S)-4-chloro-3-hydroxybutanoate
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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
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Categories:
Active Pharmaceutical Ingredients > Hormones and the Endocrine System
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CAS No:
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.
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
Recommended Suppliers of Ethyl (3S)-4-chloro-3-hydroxybutanoate
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Ethyl (3S)-4-chloro-3-hydroxybutanoate
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