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188854-47-9 | Cyclotridecanemethanol
CAS No: 188854-47-9 Catalog No: AG002HEJ MDL No:
Product Description
Catalog Number:
AG002HEJ
Chemical Name:
Cyclotridecanemethanol
CAS Number:
188854-47-9
Molecular Formula:
C14H28O
Molecular Weight:
212.3715
IUPAC Name:
cyclotridecylmethanol
InChI:
InChI=1S/C14H28O/c15-13-14-11-9-7-5-3-1-2-4-6-8-10-12-14/h14-15H,1-13H2
InChI Key:
BVZKLVKFAZVOHE-UHFFFAOYSA-N
SMILES:
OCC1CCCCCCCCCCCC1
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.214g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.377g/mol
Monoisotopic Mass:
212.214g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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