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Home > Other Heterocycles > 765-54-8
765-54-8 | 6-oxabicyclo[3.1.0]hexan-2-ol
CAS No: 765-54-8 Catalog No: AG005B2C MDL No:
Product Description
Catalog Number:
AG005B2C
Chemical Name:
6-oxabicyclo[3.1.0]hexan-2-ol
CAS Number:
765-54-8
Molecular Formula:
C5H8O2
Molecular Weight:
100.1158
IUPAC Name:
6-oxabicyclo[3.1.0]hexan-2-ol
InChI:
InChI=1S/C5H8O2/c6-3-1-2-4-5(3)7-4/h3-6H,1-2H2
InChI Key:
NEMITCBDWZCQGL-UHFFFAOYSA-N
SMILES:
OC1CCC2C1O2
NSC Number:
60557
Properties
Complexity:
92.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
100.052g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
100.117g/mol
Monoisotopic Mass:
100.052g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
Literature
| Title | Journal |
|---|---|
| Enol formation and ring-opening in OH-initiated oxidation of cycloalkenes. | The journal of physical chemistry. A 20081225 |
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