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Home > Other Heterocycles > 786726-73-6
786726-73-6 | Bicyclo[2.2.1]hept-5-ene-2-hexanol
CAS No: 786726-73-6 Catalog No: AG0051WQ MDL No:
Product Description
Catalog Number:
AG0051WQ
Chemical Name:
Bicyclo[2.2.1]hept-5-ene-2-hexanol
CAS Number:
786726-73-6
Molecular Formula:
C13H22O
Molecular Weight:
194.3132
IUPAC Name:
6-(2-bicyclo[2.2.1]hept-5-enyl)hexan-1-ol
InChI:
InChI=1S/C13H22O/c14-8-4-2-1-3-5-12-9-11-6-7-13(12)10-11/h6-7,11-14H,1-5,8-10H2
InChI Key:
CTPYAIVBOAVBBJ-UHFFFAOYSA-N
SMILES:
OCCCCCCC1CC2CC1C=C2
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.167g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.318g/mol
Monoisotopic Mass:
194.167g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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