CCCCCCCCC1=CC=CC=C1
CAS: 2189-60-8
Name: octylbenzene
SMILES: CCCCCCCCC1=CC=CC=C1

Molecular Processing

Molecular formula
C14H22
Molecular weight
190.33
Exact mass
190.1722
XLogP
4.59
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
7
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
0
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
63.52

Supplementary Information

InChIKey: CDKDZKXSXLNROY-UHFFFAOYSA-N
Synonyme
OCTYLBENZENEn-Octylbenzene2189-60-81-PhenyloctaneBenzene, octyl-PhenyloctaneOctane, 1-phenyl-P5EAX722SIDTXSID2062240NSC-404115RefChem:167906DTXCID8036570218-582-1octyl benzeneoctyl-benzeneMFCD00009564Octylbenzol4-octylbenzene1-Phenyloctane, 98%UNII-P5EAX722SISCHEMBL104035SCHEMBL133045SCHEMBL136788SCHEMBL151723SCHEMBL151724SCHEMBL302928SCHEMBL676222orb1297819SCHEMBL1553640SCHEMBL1717457
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