CCC(CC)CO
CAS: 97-95-0
Name: 2-ethylbutan-1-ol
SMILES: CCC(CC)CO

Molecular Processing

Molecular formula
C6H14O
Molecular weight
102.18
Exact mass
102.1045
XLogP
1.41
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
7
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
1
Molar refractivity
31.16

Supplementary Information

InChIKey: TZYRSLHNPKPEFV-UHFFFAOYSA-N
Synonyme
2-Ethyl-1-butanol2-Ethylbutan-1-ol97-95-02-Ethylbutanol1-Butanol, 2-ethyl-2-Ethylbutyl alcoholPseudohexyl alcohol3-MethylolpentaneEthylbutanol2-Ethylbutanol-13-Pentylcarbinolsec-PentylcarbinolETHYL BUTANOLDTXSID204141628002VFS3HNSC-8858DTXCID0021416RefChem:596146202-621-4sec-Hexyl alcohol2-ethyl-butan-1-olNSC 8858MFCD00004744HSDB 2840EINECS 202-621-4UN2275BRN 1731254IsohexylalcoholUNII-28002VFS3HAI3-01329
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