CAS: 142-62-1
이름: hexanoic acid
SMILES:
CCCCCC(=O)OMolecular Processing
Molecular formula
C6H12O2
Molecular weight
116.16
Exact mass
116.0837
XLogP
1.65
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
8
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
0.833
Molar refractivity
31.78
Supplementary Information
InChIKey: FUZZWVXGSFPDMH-UHFFFAOYSA-N
동의어
HEXANOIC ACIDCaproic acid142-62-1n-Caproic acidn-Hexanoic acidCapronic acid1-Hexanoic acidHexoic acidButylacetic acidPentylformic acidn-Hexylic acidn-Hexoic acidPentiformic acid1-Pentanecarboxylic acidHexylic acidPentanecarboxylic acidHexacid 698Kyselina kapronovaFEMA No. 2559DTXSID70216071F8SN134MXNSC8266NSC-8266DTXCID101607CHEBI:30776NSC-35598Bi(OHex)3fatty acid 6:0RefChem:31611205-550-7
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