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Home > Other Heterocycles > 83961-73-3
83961-73-3 | 1-Azabicyclo[3.2.0]hept-2-en-7-one
CAS No: 83961-73-3 Catalog No: AG004R3R MDL No:
Product Description
Catalog Number:
AG004R3R
Chemical Name:
1-Azabicyclo[3.2.0]hept-2-en-7-one
CAS Number:
83961-73-3
Molecular Formula:
C6H7NO
Molecular Weight:
109.1259
IUPAC Name:
1-azabicyclo[3.2.0]hept-2-en-7-one
InChI:
InChI=1S/C6H7NO/c8-6-4-5-2-1-3-7(5)6/h1,3,5H,2,4H2
InChI Key:
YZBQHRLRFGPBSL-UHFFFAOYSA-N
SMILES:
C1C2CC=CN2C1=O
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
109.053g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
109.128g/mol
Monoisotopic Mass:
109.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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