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Home > Other Heterocycles > 77627-60-2
77627-60-2 | Bicyclo[4.2.0]octa-1,3,5-triene-2,5-diol
CAS No: 77627-60-2 Catalog No: AG0058ST MDL No:
Product Description
Catalog Number:
AG0058ST
Chemical Name:
Bicyclo[4.2.0]octa-1,3,5-triene-2,5-diol
CAS Number:
77627-60-2
Molecular Formula:
C8H8O2
Molecular Weight:
136.1479
IUPAC Name:
bicyclo[4.2.0]octa-1,3,5-triene-2,5-diol
InChI:
InChI=1S/C8H8O2/c9-7-3-4-8(10)6-2-1-5(6)7/h3-4,9-10H,1-2H2
InChI Key:
GFPYPUDPPWWSDF-UHFFFAOYSA-N
SMILES:
Oc1ccc(c2c1CC2)O
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.052g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
136.15g/mol
Monoisotopic Mass:
136.052g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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