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Home > Other Heterocycles > 77059-21-3
77059-21-3 | 13-Oxabicyclo[10.1.0]tridecan-2-ol
CAS No: 77059-21-3 Catalog No: AG005EFY MDL No:
Product Description
Catalog Number:
AG005EFY
Chemical Name:
13-Oxabicyclo[10.1.0]tridecan-2-ol
CAS Number:
77059-21-3
Molecular Formula:
C12H22O2
Molecular Weight:
198.3019
IUPAC Name:
13-oxabicyclo[10.1.0]tridecan-2-ol
InChI:
InChI=1S/C12H22O2/c13-10-8-6-4-2-1-3-5-7-9-11-12(10)14-11/h10-13H,1-9H2
InChI Key:
QBOBVOACZNCACE-UHFFFAOYSA-N
SMILES:
OC1CCCCCCCCCC2C1O2
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.162g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.306g/mol
Monoisotopic Mass:
198.162g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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