Monomers
2-Methyl-1-butene
Identifiers
IUPAC name
2-methylbut-1-ene
InchI
InChI=1S/C5H10/c1-4-5(2)3/h2,4H2,1,3H3
InchI Key
MHNNAWXXUZQSNM-UHFFFAOYSA-N
SMILES
CCC(=C)C
Canonical SMILES
CCC(=C)C
Isomeric SMILES
CCC(=C)C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H10
Heavy Atom Count
5
Molecular Weight
70.135
Exact Molecular Weight
70.0783
Valence Electrons
30
Radical Electrons
0
tPSA
0.0
MolLogP
1.9725
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
15 14 0 0 0 0 0 0 0 0999 V2000
1.8537 0.4406 0.2652 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7614 -0.5854 0.1533 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5692 0.0234 -0.0988 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7952 1.3053 -0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7103 -0.9355 -0.2228 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8027 -0.1078 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8861 1.0809 -0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6869 1.0754 1.1382 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7011 -1.1212 1.1299 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0261 -1.3028 -0.6444 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7847 1.6670 -0.3968 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0084 2.0097 -0.1295 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6703 -0.4149 -0.3815 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7139 -1.5546 0.6858 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4825 -1.5801 -1.0895 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 2 3
3 5 1 0
1 6 1 0
1 7 1 0
1 8 1 0
2 9 1 0
2 10 1 0
4 11 1 0
4 12 1 0
5 13 1 0
5 14 1 0
5 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers