200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 845896-81-3
845896-81-3 | Bicyclo[6.1.0]nona-1,3,5,7-tetraene
CAS No: 845896-81-3 Catalog No: AG00529W MDL No:
Product Description
Catalog Number:
AG00529W
Chemical Name:
Bicyclo[6.1.0]nona-1,3,5,7-tetraene
CAS Number:
845896-81-3
Molecular Formula:
C9H8
Molecular Weight:
116.1598
IUPAC Name:
bicyclo[6.1.0]nona-1(8),2,4,6-tetraene
InChI:
InChI=1S/C9H8/c1-2-4-6-9-7-8(9)5-3-1/h1-6H,7H2
InChI Key:
PILQRERFYKUXRN-UHFFFAOYSA-N
SMILES:
C1=CC=C2C(=CC=C1)C2
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.063g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
116.163g/mol
Monoisotopic Mass:
116.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
3
XLogP3:
2.3
Related Products
© 2019 Angene International Limited. All rights Reserved.