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(2S)-2-amino-2-(2-fluorophenyl)acetic acid

HCID 853013
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Basic information

CAS
138751-04-9
Standard SMILES
N[C@H](C(=O)O)c1ccccc1F
InChIKey
CGNMJIBUVDGMIY-ZETCQYMHSA-N
Molecular formula
C8H8FNO2
Average molar mass
169.15 g/mol
Monoisotopic mass
169.05390666

Names & identifiers

Preferred name
(2S)-2-amino-2-(2-fluorophenyl)acetic acid
IUPAC
(2S)-2-amino-2-(2-fluorophenyl)acetic acid
English name
(S)-Amino-(2-fluoro-phenyl)-acetic acid
Molecular formula
C8H8FNO2
Molecular weight
169.15

Names & synonyms

138751-04-9(2S)-2-amino-2-(2-fluorophenyl)acetic acid(S)-2-AMINO-2-(2-FLUOROPHENYL)ACETIC ACID(S)-AMINO-(2-FLUORO-PHENYL)-ACETIC ACID(2S)-2-azaniumyl-2-(2-fluorophenyl)acetateMFCD06858446(2S)-Amino(2-fluorophenyl)acetic acidSCHEMBL27967493DTXSID20357386H62853(S)-2-AMINO-2-(2-FLUOROPHENYL)ACETICACIDS-2-FluoroPhenylglycine
Show more names
Benzeneacetic acid, α-amino-2-fluoro-, (αS)-

Database identifiers

CAS
138751-04-9
PubChem CID
853013
DTXSID
DTXSID20357386
Nikkaji
J231.898I

Properties

Computed structural properties

XLogP
-1.6
Topological polar surface area
63.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
12
Formal charge
0
Complexity
174

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Compound notes

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