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122751-79-5 | Triacontanoic acid, 2-hydroxy-
CAS No: 122751-79-5 Catalog No: AG000JA6 MDL No:
Product Description
Catalog Number:
AG000JA6
Chemical Name:
Triacontanoic acid, 2-hydroxy-
CAS Number:
122751-79-5
Molecular Formula:
C30H60O3
Molecular Weight:
468.7956
IUPAC Name:
2-hydroxytriacontanoic acid
InChI:
InChI=1S/C30H60O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29(31)30(32)33/h29,31H,2-28H2,1H3,(H,32,33)
InChI Key:
FOPDLHYJCVRBAQ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C(=O)O)O
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
468.454g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
468.807g/mol
Monoisotopic Mass:
468.454g/mol
Rotatable Bond Count:
28
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
14
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