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119-68-6 | Benzoic acid, 2-(methylamino)-
CAS No: 119-68-6 Catalog No: AG000OZV MDL No:MFCD00002424
Product Description
Catalog Number:
AG000OZV
Chemical Name:
Benzoic acid, 2-(methylamino)-
CAS Number:
119-68-6
Molecular Formula:
C8H9NO2
Molecular Weight:
151.1626
MDL Number:
MFCD00002424
IUPAC Name:
2-(methylamino)benzoic acid
InChI:
InChI=1S/C8H9NO2/c1-9-7-5-3-2-4-6(7)8(10)11/h2-5,9H,1H3,(H,10,11)
InChI Key:
WVMBPWMAQDVZCM-UHFFFAOYSA-N
SMILES:
CNc1ccccc1C(=O)O
EC Number:
204-343-9
UNII:
VPB2514IUJ
NSC Number:
3782
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.063g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
151.165g/mol
Monoisotopic Mass:
151.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
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