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Home > Other Heterocycles > 7095-82-1
7095-82-1 | Bicyclo[3.1.1]hept-2-ene
CAS No: 7095-82-1 Catalog No: AG00626T MDL No:
Product Description
Catalog Number:
AG00626T
Chemical Name:
Bicyclo[3.1.1]hept-2-ene
CAS Number:
7095-82-1
Molecular Formula:
C7H10
Molecular Weight:
94.1543
IUPAC Name:
bicyclo[3.1.1]hept-2-ene
InChI:
InChI=1S/C7H10/c1-2-6-4-7(3-1)5-6/h1-2,6-7H,3-5H2
InChI Key:
DEVHXDJLQMAWLM-UHFFFAOYSA-N
SMILES:
C1=CC2CC(C1)C2
Properties
Complexity:
96.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
94.078g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
94.157g/mol
Monoisotopic Mass:
94.078g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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