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Home > Other Heterocycles > 822-80-0
822-80-0 | Bicyclo[2.2.1]hepta-2,5-dien-7-ol
CAS No: 822-80-0 Catalog No: AG005GHZ MDL No:
Product Description
Catalog Number:
AG005GHZ
Chemical Name:
Bicyclo[2.2.1]hepta-2,5-dien-7-ol
CAS Number:
822-80-0
Molecular Formula:
C7H8O
Molecular Weight:
108.1378
IUPAC Name:
bicyclo[2.2.1]hepta-2,5-dien-7-ol
InChI:
InChI=1S/C7H8O/c8-7-5-1-2-6(7)4-3-5/h1-8H
InChI Key:
YKRVEGFRYRZTEY-UHFFFAOYSA-N
SMILES:
OC1C2C=CC1C=C2
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
108.058g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
108.14g/mol
Monoisotopic Mass:
108.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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