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88775-06-8 | 2-Propanol, 1-(nonylphenoxy)-
CAS No: 88775-06-8 Catalog No: AG004B2K MDL No:
Product Description
Catalog Number:
AG004B2K
Chemical Name:
2-Propanol, 1-(nonylphenoxy)-
CAS Number:
88775-06-8
Molecular Formula:
C18H30O2
Molecular Weight:
278.4296
IUPAC Name:
1-(2-nonylphenoxy)propan-2-ol
InChI:
InChI=1S/C18H30O2/c1-3-4-5-6-7-8-9-12-17-13-10-11-14-18(17)20-15-16(2)19/h10-11,13-14,16,19H,3-9,12,15H2,1-2H3
InChI Key:
FCZXXMWYJSLQKF-UHFFFAOYSA-N
SMILES:
CCCCCCCCCc1ccccc1OCC(O)C
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.225g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.436g/mol
Monoisotopic Mass:
278.225g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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