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192508-66-0 | Tetradecanoic acid, 3-(phenylmethoxy)-, (3S)-
CAS No: 192508-66-0 Catalog No: AG002G0M MDL No:
Product Description
Catalog Number:
AG002G0M
Chemical Name:
Tetradecanoic acid, 3-(phenylmethoxy)-, (3S)-
CAS Number:
192508-66-0
Molecular Formula:
C21H34O3
Molecular Weight:
334.4929
IUPAC Name:
(3S)-3-phenylmethoxytetradecanoic acid
InChI:
InChI=1S/C21H34O3/c1-2-3-4-5-6-7-8-9-13-16-20(17-21(22)23)24-18-19-14-11-10-12-15-19/h10-12,14-15,20H,2-9,13,16-18H2,1H3,(H,22,23)/t20-/m0/s1
InChI Key:
NDCDVTWILZGAIG-FQEVSTJZSA-N
SMILES:
CCCCCCCCCCC[C@@H](CC(=O)O)OCc1ccccc1
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
334.251g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
334.5g/mol
Monoisotopic Mass:
334.251g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.7
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