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4228-00-6 | Phenyl Laurate
CAS No: 4228-00-6 Catalog No: AG0038QJ MDL No:MFCD00041917
Product Description
Catalog Number:
AG0038QJ
Chemical Name:
Phenyl Laurate
CAS Number:
4228-00-6
Molecular Formula:
C18H28O2
Molecular Weight:
276.4137
MDL Number:
MFCD00041917
IUPAC Name:
phenyl dodecanoate
InChI:
InChI=1S/C18H28O2/c1-2-3-4-5-6-7-8-9-13-16-18(19)20-17-14-11-10-12-15-17/h10-12,14-15H,2-9,13,16H2,1H3
InChI Key:
ZPORCTAUIXXZAI-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCC(=O)Oc1ccccc1
EC Number:
224-178-6
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.209g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.42g/mol
Monoisotopic Mass:
276.209g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.8
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