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1094306-18-9 | 3-Chloro-6-n-hexyloxybenzyl alcohol
CAS No: 1094306-18-9 Catalog No: AG01FDPR MDL No:
Product Description
Catalog Number:
AG01FDPR
Chemical Name:
3-Chloro-6-n-hexyloxybenzyl alcohol
CAS Number:
1094306-18-9
Molecular Formula:
C13H19ClO2
Molecular Weight:
242.7418
IUPAC Name:
(5-chloro-2-hexoxyphenyl)methanol
InChI:
InChI=1S/C13H19ClO2/c1-2-3-4-5-8-16-13-7-6-12(14)9-11(13)10-15/h6-7,9,15H,2-5,8,10H2,1H3
InChI Key:
ICXCUGPDSPBCAI-UHFFFAOYSA-N
SMILES:
CCCCCCOc1ccc(cc1CO)Cl
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.107g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.743g/mol
Monoisotopic Mass:
242.107g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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