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PHENYLACETIC-2,2-D2ACID

PHENYLACETIC-2,2-D2ACID structure

CAS No:
1076-07-9
Formula:
C8H6D2O2
Chemical Name:
PHENYLACETIC-2,2-D2ACID
Synonyms:
Phenylacetic-2,2-d2 acid;2,2-dideuterio-2-phenylacetic acid;Benzeneacetic-d2 acid;SCHEMBL1551612;Phenylacetic acid-alpha,alpha-d2;DTXSID10480051;Benzene(alpha,alpha-2H2)acetic acid;AKOS015914427;Phenylacetic acid-alpha,alpha-d2, 98 atom % D;J-001914

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PHENYLACETIC-2,2-D2ACID Basic Attributes

Molecular Weight：

138.16000

Exact Mass：

138.06500

DSSTox ID：

DTXSID10480051

Characteristics

PSA：

37.30000

XLogP3：

1.31370

Density：

1.182g/cm3

Melting Point：

76-78ºC(lit.)

Boiling Point：

265.5ºC at 760 mmHg

Flash Point：

156.2ºC

Refractive Index：

1.552

Safety Information

Transport codes：

UN 3335

hazard class code：

R36/37/38

safety instructions：

26-36

Marks：

Xi: Irritant;

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

Computed Properties

Molecular Weight:138.16
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:138.064982986
Monoisotopic Mass:138.064982986
Topological Polar Surface Area:37.3
Heavy Atom Count:10
Complexity:114
Isotope Atom Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of PHENYLACETIC-2,2-D2ACID

Basic Attributes
Characteristics
Safety Information
Computed Properties

PHENYLACETIC-2,2-D2ACID

SDS

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