CAS: 589-92-4
이름: 4-methylcyclohexan-1-one
SMILES:
CC1CCC(=O)CC1Molecular Processing
Molecular formula
C7H12O
Molecular weight
112.17
Exact mass
112.0888
XLogP
1.77
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
8
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
0.857
Molar refractivity
32.64
Supplementary Information
InChIKey: VGVHNLRUAMRIEW-UHFFFAOYSA-N
동의어
4-METHYLCYCLOHEXANONE589-92-44-methylcyclohexan-1-oneCyclohexanone, 4-methyl-4-Methyl-1-cyclohexanoneMetylocykloheksanonMethyl-4 cyclohexanone-1Cyclohexanone, methyl-Methyl-4 cyclohexanone-1 [French]NSC 3816EINECS 209-665-3Metylocykloheksanon [Polish]CYCLOHEXANONE,4-METHYLBRN 0506746AI3-159160L1R78K79SNSC-3816EINECS 215-556-1DTXSID5060435FEMA NO. 39484-07-00-00044 (Beilstein Handbook Reference)4-METHYLCYCLOHEXANONE [FHFI]Tetrahydropcresol4Methyl1cyclohexanoneCyclohexanone, 4methylMethyl4 cyclohexanone1RefChem:525575DTXCID1042499209-665-3InChI=1/C7H12O/c1-6-2-4-7(8)5-3-6/h6H,2-5H2,1H
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