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10255-95-5 | Propanediamide, 2-phenyl-
CAS No: 10255-95-5 Catalog No: AG0007PW MDL No:MFCD00051776
Product Description
Catalog Number:
AG0007PW
Chemical Name:
Propanediamide, 2-phenyl-
CAS Number:
10255-95-5
Molecular Formula:
C9H10N2O2
Molecular Weight:
178.1879
MDL Number:
MFCD00051776
IUPAC Name:
2-phenylpropanediamide
InChI:
InChI=1S/C9H10N2O2/c10-8(12)7(9(11)13)6-4-2-1-3-5-6/h1-5,7H,(H2,10,12)(H2,11,13)
InChI Key:
CPSUAFUQJBJMPO-UHFFFAOYSA-N
SMILES:
NC(=O)C(c1ccccc1)C(=O)N
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.074g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
178.191g/mol
Monoisotopic Mass:
178.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
86.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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