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(+)-Phenylsuccinic acid

(+)-Phenylsuccinic acid structure

CAS No:
4036-30-0
Formula:
C10H10O4
Chemical Name:
(+)-Phenylsuccinic acid
Synonyms:
Butanedioic acid,2-phenyl-,(2S)-;Succinic acid,phenyl-,D-(+)-;Butanedioic acid,phenyl-,(S)-;Butanedioic acid,phenyl-,(2S)-;(2S)-2-Phenylbutanedioic acid;(+)-Phenylsuccinic acid;(S)-Phenylsuccinic acid;(+)-2-Phenylsuccinic acid;(S)-2-Phenylsuccinic acid;(S)-(+)-Phenylsuccinic acid;(2S)-2-Phenylbutanedioic acid
Categories:
Chemical Reagents > Organic Reagents

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Description

almost white micro-crystalline powder

(+)-Phenylsuccinic acid Basic Attributes

Molecular Weight：

194.184

Exact Mass：

194.18

EC Number：

223-719-3

HScode：

2917399090

Characteristics

PSA：

74.60000

XLogP3：

1.22

Appearance：

Almost white.

Density：

1.3±0.1 g/cm3

Melting Point：

138-140 °C

Boiling Point：

307.8±22.0 °C at 760 mmHg

Flash Point：

154.2±18.8 °C

Refractive Index：

1.578

Storage Conditions：

Store in a cool, dry place. Keep container closed when not in use.

Vapor Pressure：

0.000306mmHg at 25°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R36/37/38

safety instructions：

S26-S37/39

Marks：

Xi:Irritant;

Stability/Shelf Life：

Stable under normal temperatures and pressures.

Precautionary statement(s)：

P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:194.18
XLogP3:0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:194.05790880
Monoisotopic Mass:194.05790880
Topological Polar Surface Area:74.6
Heavy Atom Count:14
Complexity:218
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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