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13037-87-1 | Phenol, 4-(dodecyloxy)-
CAS No: 13037-87-1 Catalog No: AG000UCK MDL No:
Product Description
Catalog Number:
AG000UCK
Chemical Name:
Phenol, 4-(dodecyloxy)-
CAS Number:
13037-87-1
Molecular Formula:
C18H30O2
Molecular Weight:
278.4296
IUPAC Name:
4-dodecoxyphenol
InChI:
InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-16-20-18-14-12-17(19)13-15-18/h12-15,19H,2-11,16H2,1H3
InChI Key:
FHXJDKPJCDJBEM-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCOc1ccc(cc1)O
Properties
Complexity:
198
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:
12
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.3
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