CCCCCCC(O)CCCCCCCCCCC(=O)O
CAS: 106-14-9
Nom: 12-hydroxyoctadecanoic acid
SMILES: CCCCCCC(O)CCCCCCCCCCC(=O)O

Molecular Processing

Molecular formula
C18H36O3
Molecular weight
300.48
Exact mass
300.2664
XLogP
5.3
TPSA
57.53
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
16
Heavy atoms
21
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.944
Molar refractivity
88.57

Supplementary Information

InChIKey: ULQISTXYYBZJSJ-UHFFFAOYSA-N
Synonymes
12-Hydroxystearic acid12-HYDROXYOCTADECANOIC ACID106-14-9DL-12-Hydroxystearic acidCerit Fac 3Hydrofol acid 200Ceroxin GLBarolub FTOStearic acid, 12-hydroxy-Loxiol G 21NSC 238512-hydroxy-octadecanoic acidDTXSID8026725HSDB 5368EINECS 203-366-1EINECS 253-004-1UNII-933ANU3H2SBRN 1726730933ANU3H2SAI3-19730CASID HSANSC-2385DL-12-HYDROXYOCTADECANOIC ACIDDTXCID606725KOWCHEBI:85208EC 203-366-14-03-00-00942 (Beilstein Handbook Reference)12-HYDROXYSTEARIC ACID (USP-RS)12-HYDROXYSTEARIC ACID [USP-RS]
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Impliqué dans 21 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→