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88646-89-3 | 2-Furanoctanol, 5-hexyl-
CAS No: 88646-89-3 Catalog No: AG0049DR MDL No:
Product Description
Catalog Number:
AG0049DR
Chemical Name:
2-Furanoctanol, 5-hexyl-
CAS Number:
88646-89-3
Molecular Formula:
C18H32O2
Molecular Weight:
280.4455
IUPAC Name:
8-(5-hexylfuran-2-yl)octan-1-ol
InChI:
InChI=1S/C18H32O2/c1-2-3-4-9-12-17-14-15-18(20-17)13-10-7-5-6-8-11-16-19/h14-15,19H,2-13,16H2,1H3
InChI Key:
DLDCBORKRFVXTJ-UHFFFAOYSA-N
SMILES:
CCCCCCc1ccc(o1)CCCCCCCCO
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.24g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
280.452g/mol
Monoisotopic Mass:
280.24g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
33.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1
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