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
1.8063 -0.6623 -0.1189 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8350 0.4487 -0.3432 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5798 0.0566 -0.1632 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9961 -1.1385 0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5895 1.1377 -0.3779 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8886 -1.3621 -0.9746 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8044 -0.1862 0.1046 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5857 -1.2866 0.7711 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9544 0.7762 -1.4153 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0841 1.3266 0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0400 -1.3392 0.2725 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2954 -1.9361 0.3229 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5293 0.6691 -0.7121 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7196 1.6099 0.6341 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2089 1.8861 -1.1195 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