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887588-62-7 | (3-Aminoazetidin-1-yl);(phenyl);methanone
CAS No: 887588-62-7 Catalog No: AG004BWF MDL No:MFCD07786941
Product Description
Catalog Number:
AG004BWF
Chemical Name:
(3-Aminoazetidin-1-yl);(phenyl);methanone
CAS Number:
887588-62-7
Molecular Formula:
C10H12N2O
Molecular Weight:
176.2151
MDL Number:
MFCD07786941
IUPAC Name:
(3-aminoazetidin-1-yl)-phenylmethanone
InChI:
InChI=1S/C10H12N2O/c11-9-6-12(7-9)10(13)8-4-2-1-3-5-8/h1-5,9H,6-7,11H2
InChI Key:
UMVRSUKQZOUCCV-UHFFFAOYSA-N
SMILES:
NC1CN(C1)C(=O)c1ccccc1
Properties
Complexity:
193
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:
1
Isotope Atom Count:
0
Molecular Weight:
176.219g/mol
Monoisotopic Mass:
176.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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