CCCCCCCCCCCCCCCCCCCCCC(=O)O
CAS: 112-85-6
Name: docosanoic acid
SMILES: CCCCCCCCCCCCCCCCCCCCCC(=O)O

Molecular Processing

Molecular formula
C22H44O2
Molecular weight
340.59
Exact mass
340.3341
XLogP
7.89
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
20
Heavy atoms
24
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.955
Molar refractivity
105.65

Supplementary Information

InChIKey: UKMSUNONTOPOIO-UHFFFAOYSA-N
Synonyme
Docosanoic acidBehenic acid112-85-6N-DOCOSANOIC ACID1-Docosanoic acidHydrofol Acid 560Hydrofol 2022-55Glycon B-70Docosoic acidHystrene 5522Hystrene 9022Glycon B 70Prifrac 2989Edenor C 22-85RCHEBI:28941CRODACID BORISTAR BAC22:0NSC-32364H390488X0AEXL-5PRIFRAC 2987NAA 22SNAA 222SDTXSID3026930NSC32364fatty acid 22:0RefChem:29729DTXCID306930204-010-8
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