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Butanoic acid, 4-chloro-3-hydroxy-, ethyl ester

Butanoic acid, 4-chloro-3-hydroxy-, ethyl ester structure

CAS No:
10488-69-4
Formula:
C6H11ClO3
Chemical Name:
Butanoic acid, 4-chloro-3-hydroxy-, ethyl ester
Synonyms:
Butanoic acid,4-chloro-3-hydroxy-,ethyl ester;Butyric acid,4-chloro-3-hydroxy-,ethyl ester;Ethyl 4-chloro-3-hydroxybutyrate;Ethyl γ-chloro-β-hydroxybutyrate;Ethyl 4-chloro-3-hydroxybutanoate;4-Chloro-3-hydroxybutanoic acid ethyl ester;(±)-Ethyl 4-chloro-3-hydroxybutyrate;4-Chloro-3-hydroxybutyric acid ethyl ester;87068-18-6
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Butanoic acid, 4-chloro-3-hydroxy-, ethyl ester Basic Attributes

Molecular Weight：

166.60300

Exact Mass：

166.60

DSSTox ID：

DTXSID90402594

HScode：

2918199090

Characteristics

PSA：

46.53000

XLogP3：

0.4

Density：

1.1257 g/cm³ @ Temp: 16 °C

Melting Point：

136 °C

Boiling Point：

155-157 °C @ Press: 10 Torr

Flash Point：

113.125ºC

Refractive Index：

1.453

Water Solubility：

H2O: soluble (62 g/L) (25 ºC)

Safety Information

GHS Classification：

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P310, P330, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

4-chloro-3-hydroxybutyric acid ethyl ester

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
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Ethanol

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Guide of Butanoic acid, 4-chloro-3-hydroxy-, ethyl ester

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
Material
Recommended Suppliers
Latest News
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Butanoic acid, 4-chloro-3-hydroxy-, ethyl ester

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