CC1C2CCC(C2)(CC1=O)C
이름: 1,4-dimethylbicyclo[3.2.1]octan-3-one
SMILES: CC1C2CCC(C2)(CC1=O)C

Molecular Processing

Molecular formula
C10H16O
Molecular weight
152.24
Exact mass
152.1201
XLogP
2.4
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.9
Molar refractivity
44.24

Supplementary Information

InChIKey: JXACUVOVPRSYFX-UHFFFAOYSA-N
동의어
SCHEMBL1277001JXACUVOVPRSYFX-UHFFFAOYSA-N1,4-dimethyl-bicyclo[3.2.1]octan-3-one
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