CCCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCCCCCC)CC(=O)O
CAS: 83549-90-0
Name: 3-hexadecanoyloxyoctadecanoic acid
SMILES: CCCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCCCCCC)CC(=O)O

Molecular Processing

Molecular formula
C34H66O4
Molecular weight
538.9
Exact mass
538.4961
XLogP
11.34
TPSA
63.6
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
31
Heavy atoms
38
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.941
Molar refractivity
162.76

Supplementary Information

InChIKey: UKZPVOXSOKDEQO-UHFFFAOYSA-N
Synonyme
3-Hexadecanoyloxyoctadecanoic acid83549-90-03-(HEXADECANOYLOXY)OCTADECANOIC ACID3-PAHSASCHEMBL10803336DTXSID10542047UKZPVOXSOKDEQO-UHFFFAOYSA-N3-hexadecanoyloxy-octadecanoic acid3-PAHSA;3-palmitoyloxystearic AcidLMFA07090072FAHFA 16:0/3O(FA 18:0)
Quelle anzeigen →
An 32 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→