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Home > Other Heterocycles > 25444-64-8
25444-64-8 | Bicyclo[4.2.2]deca-2,4,7-triene
CAS No: 25444-64-8 Catalog No: AG006UUO MDL No:
Product Description
Catalog Number:
AG006UUO
Chemical Name:
Bicyclo[4.2.2]deca-2,4,7-triene
CAS Number:
25444-64-8
Molecular Formula:
C10H12
Molecular Weight:
132.2023
IUPAC Name:
bicyclo[4.2.2]deca-2,4,7-triene
InChI:
InChI=1S/C10H12/c1-2-4-10-7-5-9(3-1)6-8-10/h1-5,7,9-10H,6,8H2
InChI Key:
HBVGDLAYTNCSPJ-UHFFFAOYSA-N
SMILES:
C1=CC2CCC(C=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:
2
XLogP3:
3.4
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