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141446-68-6 | Octadecanoic acid, 7,10-dihydroxy-
CAS No: 141446-68-6 Catalog No: AG001GEW MDL No:
Product Description
Catalog Number:
AG001GEW
Chemical Name:
Octadecanoic acid, 7,10-dihydroxy-
CAS Number:
141446-68-6
Molecular Formula:
C18H36O4
Molecular Weight:
316.4760
IUPAC Name:
7,10-dihydroxyoctadecanoic acid
InChI:
InChI=1S/C18H36O4/c1-2-3-4-5-6-8-11-16(19)14-15-17(20)12-9-7-10-13-18(21)22/h16-17,19-20H,2-15H2,1H3,(H,21,22)
InChI Key:
VBWCAPTXMJNYAJ-UHFFFAOYSA-N
SMILES:
CCCCCCCCC(CCC(CCCCCC(=O)O)O)O
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.261g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
316.482g/mol
Monoisotopic Mass:
316.261g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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