CC(C)(C)C=C
CAS: 558-37-2
Название: 3,3-dimethylbut-1-ene
SMILES: CC(C)(C)C=C

Molecular Processing

Molecular formula
C6H12
Molecular weight
84.16
Exact mass
84.0939
XLogP
2.22
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
0
Heavy atoms
6
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
0
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
29.65

Supplementary Information

InChIKey: PKXHXOTZMFCXSH-UHFFFAOYSA-N
Синонимы
3,3-DIMETHYL-1-BUTENE558-37-2Neohexene3,3-Dimethylbut-1-enetert-Butylethylene1-Butene, 3,3-dimethyl-tert-Butylethenetert-HexeneTrimethylvinylmethane3,3-Dimethylbutene2,2-Dimethyl-3-butene3,3-Dimethy-1-buteneMFCD00008853DTXSID1027211NSC 7411901ZB73D2KK3,3-Dimethyl-1-butene;NeohexeneNSC-74119DTXCID807211CAS-558-37-2UNII-01ZB73D2KKNSC74119EINECS 209-195-9SCHEMBL19782SCHEMBL21664SCHEMBL42320(CH3)3CCH=CH2SCHEMBL277083SCHEMBL4061555SCHEMBL4985102
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