C=CCCCCCC(=O)O
CAS: 18719-24-9
Name: oct-7-enoic acid
SMILES: C=CCCCCCC(=O)O

Molecular Processing

Molecular formula
C8H14O2
Molecular weight
142.2
Exact mass
142.0994
XLogP
2.21
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
6
Heavy atoms
10
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
0.625
Molar refractivity
40.92

Supplementary Information

InChIKey: OZYYQTRHHXLTKX-UHFFFAOYSA-N
Synonyme
7-Octenoic acidoct-7-enoic acid18719-24-9UMY8YV4JPRDTXSID30337674RefChem:106493DTXCID60288761686-909-9MFCD02258724oct-7-enoicacidUNII-UMY8YV4JPR7-Octenoic acid, 97%SCHEMBL4815397-Octenoic acid; C8:1n-1orb3023313SCHEMBL3176467SCHEMBL7780721CHEBI:180307C8:1n-1LMFA01030576TN9717AKOS006280748DS-8614DA-08876SY240016CS-0147251I11997EN300-1588859F200744
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