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89711-24-0 | Phenol, 5-ethoxy-2-hexyl-3-methoxy-4-methyl-
CAS No: 89711-24-0 Catalog No: AG0042EM MDL No:
Product Description
Catalog Number:
AG0042EM
Chemical Name:
Phenol, 5-ethoxy-2-hexyl-3-methoxy-4-methyl-
CAS Number:
89711-24-0
Molecular Formula:
C16H26O3
Molecular Weight:
266.3758
IUPAC Name:
5-ethoxy-2-hexyl-3-methoxy-4-methylphenol
InChI:
InChI=1S/C16H26O3/c1-5-7-8-9-10-13-14(17)11-15(19-6-2)12(3)16(13)18-4/h11,17H,5-10H2,1-4H3
InChI Key:
HMBDGXKTLQHAIT-UHFFFAOYSA-N
SMILES:
CCCCCCc1c(O)cc(c(c1OC)C)OCC
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.188g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
266.381g/mol
Monoisotopic Mass:
266.188g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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