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113890-00-9 | Propanamide, 2-amino-N-(2-methylphenyl)-, (2S)-
CAS No: 113890-00-9 Catalog No: AG000A0G MDL No:
Product Description
Catalog Number:
AG000A0G
Chemical Name:
Propanamide, 2-amino-N-(2-methylphenyl)-, (2S)-
CAS Number:
113890-00-9
Molecular Formula:
C10H14N2O
Molecular Weight:
178.2310
IUPAC Name:
2-amino-N-(2-methylphenyl)propanamide
InChI:
InChI=1S/C10H14N2O/c1-7-5-3-4-6-9(7)12-10(13)8(2)11/h3-6,8H,11H2,1-2H3,(H,12,13)
InChI Key:
BEXOMEKJRGSLNS-UHFFFAOYSA-N
SMILES:
O=C([C@@H](N)C)Nc1ccccc1C
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.111g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
178.235g/mol
Monoisotopic Mass:
178.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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