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Benzeneacetic acid, α-amino-2-chloro-, methyl ester, hydrochloride (1:1), (αS)-

Benzeneacetic acid, α-amino-2-chloro-, methyl ester, hydrochloride (1:1), (αS)- structure

CAS No:
213018-92-9
Formula:
C9H10ClNO2.ClH
Chemical Name:
Benzeneacetic acid, α-amino-2-chloro-, methyl ester, hydrochloride (1:1), (αS)-
Synonyms:
Benzeneacetic acid,α-amino-2-chloro-,methyl ester,hydrochloride (1:1),(αS)-;Benzeneacetic acid,α-amino-2-chloro-,methyl ester,hydrochloride,(αS)-;(+)-(S)-Methyl α-amino-α-(2-chlorophenyl)acetate hydrochloride;Methyl (2S)-amino(2-chlorophenyl)acetate hydrochloride;Methyl (S)-2-amino-2-(2-chlorophenyl)acetate hydrochloride
Categories:
Biochemical Engineering > Amino Acids and Derivatives

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Benzeneacetic acid, α-amino-2-chloro-, methyl ester, hydrochloride (1:1), (αS)- Basic Attributes

Molecular Weight：

236.1

Exact Mass：

235.01700

EC Number：

606-736-4

DSSTox ID：

DTXSID10647829

HScode：

2922499990

Characteristics

PSA：

52.3

XLogP3：

2.79990

Safety Information

hazard class code：

36/37/38

safety instructions：

26-36/39

Marks：

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:236.09
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:235.0166840
Monoisotopic Mass:235.0166840
Topological Polar Surface Area:52.3
Heavy Atom Count:14
Complexity:187
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of Benzeneacetic acid, α-amino-2-chloro-, methyl ester, hydrochloride (1:1), (αS)-

Basic Attributes
Characteristics
Safety Information
Computed Properties
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Benzeneacetic acid, α-amino-2-chloro-, methyl ester, hydrochloride (1:1), (αS)-

SDS

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