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25178-38-5 | Benzeneacetic acid, α-amino-2-hydroxy-
CAS No: 25178-38-5 Catalog No: AG002QRH MDL No:MFCD00014348
Product Description
Catalog Number:
AG002QRH
Chemical Name:
Benzeneacetic acid, α-amino-2-hydroxy-
CAS Number:
25178-38-5
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD00014348
IUPAC Name:
2-amino-2-(2-hydroxyphenyl)acetic acid
InChI:
InChI=1S/C8H9NO3/c9-7(8(11)12)5-3-1-2-4-6(5)10/h1-4,7,10H,9H2,(H,11,12)
InChI Key:
LIDYFNYBHXPTJG-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1ccccc1O)N
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.058g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5
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