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80106-53-2 | Acetamide,2-(bicyclo[2.2.1]hept-2-ylidene)-
CAS No: 80106-53-2 Catalog No: AG005OWM MDL No:
Product Description
Catalog Number:
AG005OWM
Chemical Name:
Acetamide,2-(bicyclo[2.2.1]hept-2-ylidene)-
CAS Number:
80106-53-2
Molecular Formula:
C9H13NO
Molecular Weight:
151.2056
IUPAC Name:
(2E)-2-(2-bicyclo[2.2.1]heptanylidene)acetamide
InChI:
InChI=1S/C9H13NO/c10-9(11)5-8-4-6-1-2-7(8)3-6/h5-7H,1-4H2,(H2,10,11)/b8-5+
InChI Key:
KJRUUMKNELLDSU-VMPITWQZSA-N
SMILES:
NC(=O)C=C1CC2CC1CC2
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
151.1g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
151.209g/mol
Monoisotopic Mass:
151.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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