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phenylmandelicacid

phenylmandelicacid structure

CAS No:
450-52-2
Formula:
C14H12O3
Chemical Name:
phenylmandelicacid
Synonyms:
4-phenylmandelic acid;p-phenylmandelic acid;phenol-mandelic acid;phenylmandelic acid;phenylmandelic acid, (+-)-isomer;NSC 18768

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phenylmandelicacid Basic Attributes

Molecular Weight：

228.24300

Exact Mass：

228.07900

NSC Number：

18768

HScode：

2918199090

Characteristics

PSA：

57.53000

XLogP3：

2.47160

Density：

1.265g/cm3

Boiling Point：

440.5ºC at 760 mmHg

Flash Point：

234.3ºC

Refractive Index：

1.621

Drug Information

MeSH Entry Terms：

4-phenylmandelic acid

Computed Properties

Molecular Weight:228.24
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:228.078644241
Monoisotopic Mass:228.078644241
Topological Polar Surface Area:57.5
Heavy Atom Count:17
Complexity:250
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of phenylmandelicacid

Basic Attributes
Characteristics
Drug Information
Computed Properties

phenylmandelicacid

SDS

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