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7468-30-6 | 2-Azetidinone, 3,3-dimethyl-4-phenyl-1- (phenylmethyl)-
CAS No: 7468-30-6 Catalog No: AG005IFN MDL No:
Product Description
Catalog Number:
AG005IFN
Chemical Name:
2-Azetidinone, 3,3-dimethyl-4-phenyl-1- (phenylmethyl)-
CAS Number:
7468-30-6
Molecular Formula:
C18H19NO
Molecular Weight:
265.3496
IUPAC Name:
1-benzyl-3,3-dimethyl-4-phenylazetidin-2-one
InChI:
InChI=1S/C18H19NO/c1-18(2)16(15-11-7-4-8-12-15)19(17(18)20)13-14-9-5-3-6-10-14/h3-12,16H,13H2,1-2H3
InChI Key:
ZBNJFYQJKLRIAA-UHFFFAOYSA-N
SMILES:
O=C1N(Cc2ccccc2)C(C1(C)C)c1ccccc1
NSC Number:
400760
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.147g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.356g/mol
Monoisotopic Mass:
265.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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