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113479-13-3 | 2-Azetidinone, 1-cyclohexyl-3-methyl-
CAS No: 113479-13-3 Catalog No: AG0008QG MDL No:
Product Description
Catalog Number:
AG0008QG
Chemical Name:
2-Azetidinone, 1-cyclohexyl-3-methyl-
CAS Number:
113479-13-3
Molecular Formula:
C10H17NO
Molecular Weight:
167.2481
IUPAC Name:
1-cyclohexyl-3-methylazetidin-2-one
InChI:
InChI=1S/C10H17NO/c1-8-7-11(10(8)12)9-5-3-2-4-6-9/h8-9H,2-7H2,1H3
InChI Key:
CHICWTYRCRLLPS-UHFFFAOYSA-N
SMILES:
O=C1C(C)CN1C1CCCCC1
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.131g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.252g/mol
Monoisotopic Mass:
167.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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