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89368-03-6 | 2-Azetidinone, 3-(1-methylethenyl)-
CAS No: 89368-03-6 Catalog No: AG003X4M MDL No:
Product Description
Catalog Number:
AG003X4M
Chemical Name:
2-Azetidinone, 3-(1-methylethenyl)-
CAS Number:
89368-03-6
Molecular Formula:
C6H9NO
Molecular Weight:
111.1418
IUPAC Name:
3-prop-1-en-2-ylazetidin-2-one
InChI:
InChI=1S/C6H9NO/c1-4(2)5-3-7-6(5)8/h5H,1,3H2,2H3,(H,7,8)
InChI Key:
AXXUTOSKMAICDY-UHFFFAOYSA-N
SMILES:
CC(=C)C1CNC1=O
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
111.068g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
111.144g/mol
Monoisotopic Mass:
111.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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