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Home > Other Heterocycles > 100959-83-9
100959-83-9 | Bicyclo[4.1.0]hepta-2,4-diene-7-carboxamide
CAS No: 100959-83-9 Catalog No: AG0003BS MDL No:
Product Description
Catalog Number:
AG0003BS
Chemical Name:
Bicyclo[4.1.0]hepta-2,4-diene-7-carboxamide
CAS Number:
100959-83-9
Molecular Formula:
C8H9NO
Molecular Weight:
135.1632
IUPAC Name:
bicyclo[4.1.0]hepta-2,4-diene-7-carboxamide
InChI:
InChI=1S/C8H9NO/c9-8(10)7-5-3-1-2-4-6(5)7/h1-7H,(H2,9,10)
InChI Key:
RPANKNGODZYXSA-UHFFFAOYSA-N
SMILES:
NC(=O)C1C2C1C=CC=C2
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.068g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
135.166g/mol
Monoisotopic Mass:
135.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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