CAS: 1653-40-3
Название: 6-methylheptan-1-ol
SMILES:
CC(C)CCCCCOMolecular Processing
Molecular formula
C8H18O
Molecular weight
130.23
Exact mass
130.1358
XLogP
2.2
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
5
Heavy atoms
9
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
40.39
Supplementary Information
InChIKey: BWDBEAQIHAEVLV-UHFFFAOYSA-N
Синонимы
Isooctan-1-olRefChem:7919986-METHYL-1-HEPTANOL1653-40-36-METHYLHEPTAN-1-OLIsooctanol1-Heptanol, 6-methyl-ISOOCTYL ALCOHOL6-Methylheptanol26952-21-66-Methylheptanol-d7MFCD000608426-Methylheptanol (90per cent)6-methyl-heptan-1-ol6-Methylheptanol (90%)IJF7D6C38T91994-92-26-Methyl-1-heptyl Alcohol (unlabelled)METHYL HEPTANOLUNII-IJF7D6C38Tisooctanols6-Methyl-1-heptyl AlcoholSCHEMBL26877MHNSCHEMBL146778orb3023483QSPL 119SCHEMBL1190544SCHEMBL9805218SCHEMBL10405917
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