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Home > Other Heterocycles > 6572-76-5
6572-76-5 | Bicyclo[3.3.2]deca-2,6,9-triene
CAS No: 6572-76-5 Catalog No: AG006P44 MDL No:
Product Description
Catalog Number:
AG006P44
Chemical Name:
Bicyclo[3.3.2]deca-2,6,9-triene
CAS Number:
6572-76-5
Molecular Formula:
C10H12
Molecular Weight:
132.2023
IUPAC Name:
bicyclo[3.3.2]deca-2,6,9-triene
InChI:
InChI=1S/C10H12/c1-3-9-5-2-6-10(4-1)8-7-9/h1-3,6-10H,4-5H2
InChI Key:
XLMVYHGCDFNOKC-UHFFFAOYSA-N
SMILES:
C1=CC2CC=CC(C1)C=C2
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.094g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.206g/mol
Monoisotopic Mass:
132.094g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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