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191859-20-8 | 1-Hexanol, 6-[4-(trans-4-pentylcyclohexyl)phenoxy]-
CAS No: 191859-20-8 Catalog No: AG002FHJ MDL No:
Product Description
Catalog Number:
AG002FHJ
Chemical Name:
1-Hexanol, 6-[4-(trans-4-pentylcyclohexyl)phenoxy]-
CAS Number:
191859-20-8
Molecular Formula:
C23H38O2
Molecular Weight:
346.5466
IUPAC Name:
6-[4-(4-pentylcyclohexyl)phenoxy]hexan-1-ol
InChI:
InChI=1S/C23H38O2/c1-2-3-6-9-20-10-12-21(13-11-20)22-14-16-23(17-15-22)25-19-8-5-4-7-18-24/h14-17,20-21,24H,2-13,18-19H2,1H3
InChI Key:
HLMXRFDCWZULRG-UHFFFAOYSA-N
SMILES:
CCCCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)OCCCCCCO
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.287g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
346.555g/mol
Monoisotopic Mass:
346.287g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.6
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