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Home > Other Heterocycles > 717815-96-8
717815-96-8 | 7-Oxabicyclo[4.1.0]hept-2-en-2-ol
CAS No: 717815-96-8 Catalog No: AG005FLP MDL No:
Product Description
Catalog Number:
AG005FLP
Chemical Name:
7-Oxabicyclo[4.1.0]hept-2-en-2-ol
CAS Number:
717815-96-8
Molecular Formula:
C6H8O2
Molecular Weight:
112.1265
IUPAC Name:
7-oxabicyclo[4.1.0]hept-2-en-2-ol
InChI:
InChI=1S/C6H8O2/c7-4-2-1-3-5-6(4)8-5/h2,5-7H,1,3H2
InChI Key:
ILEWGFZHPNCTLP-UHFFFAOYSA-N
SMILES:
OC1=CCCC2C1O2
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
112.052g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
112.128g/mol
Monoisotopic Mass:
112.052g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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