CC(C)C(C)C(=C)C=O
CAS: 85153-28-2
Name: 3,4-dimethyl-2-methylidenepentanal
SMILES: CC(C)C(C)C(=C)C=O

Molecular Processing

Molecular formula
C8H14O
Molecular weight
126.2
Exact mass
126.1045
XLogP
2.03
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
9
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
39.21

Supplementary Information

InChIKey: QUDBAGFQCACQMZ-UHFFFAOYSA-N
Synonyme
3,4-Dimethyl-2-methylenevaleraldehyde85153-28-2EINECS 285-807-83,4-dimethyl-2-methylidenepentanalSCHEMBL15129636DTXSID6010055743,4-dimethyl-2-methylene-pentanalNS00065112
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