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1219979-21-1 | Benzamide, N-3-azetidinyl-
CAS No: 1219979-21-1 Catalog No: AG0016IB MDL No:MFCD13562986
Product Description
Catalog Number:
AG0016IB
Chemical Name:
Benzamide, N-3-azetidinyl-
CAS Number:
1219979-21-1
Molecular Formula:
C10H12N2O
Molecular Weight:
176.2151
MDL Number:
MFCD13562986
IUPAC Name:
N-(azetidin-3-yl)benzamide
InChI:
InChI=1S/C10H12N2O/c13-10(12-9-6-11-7-9)8-4-2-1-3-5-8/h1-5,9,11H,6-7H2,(H,12,13)
InChI Key:
OPYOGWIZRCQGOP-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)NC1CNC1
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
176.219g/mol
Monoisotopic Mass:
176.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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