CC1(CCCCC1=O)C
CAS: 1193-47-1
Название: 2,2-dimethylcyclohexan-1-one
SMILES: CC1(CCCCC1=O)C

Molecular Processing

Molecular formula
C8H14O
Molecular weight
126.2
Exact mass
126.1045
XLogP
2.16
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
9
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.875
Molar refractivity
37.26

Supplementary Information

InChIKey: KNSPBSQWRKKAPI-UHFFFAOYSA-N
Синонимы
2,2-Dimethylcyclohexanone2,2-dimethylcyclohexan-1-oneDTXSID30870859RefChem:441412DTXCID20818543626-402-11193-47-1Cyclohexanone, 2,2-dimethyl-MFCD00134382Dimethylcyclohexanone2,2-Dimethyl-1-cyclohexanone2,2-Dimethyl cyclohexan-1-oneJP29SV6ZY9NSC-205531333-44-4Cyclohexanone, dimethyl-NSC20553EINECS 215-589-16,6-DimethylcyclohexanoneCyclohexanone,2-dimethyl-UNII-JP29SV6ZY92,2-dimethyl-cyclohexanoneSCHEMBL1046462,2-dimethyl-cyclohexan-1-oneSCHEMBL11072357SCHEMBL280484202,2-Dimethylcyclohexanone, 92%GEO-04653NSC 20553AKOS005259349
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