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
1.7546 -0.1239 -0.3888 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6030 -0.7731 0.3365 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6273 0.0625 0.3214 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2036 0.4938 1.4247 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1958 0.4009 -1.0125 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8038 -0.3779 -1.4581 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7636 0.9828 -0.2853 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6897 -0.5354 0.0894 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8602 -1.0194 1.3911 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4372 -1.7629 -0.1608 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7811 0.2409 2.3788 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0914 1.0966 1.4108 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4419 -0.5763 -1.5134 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4228 0.9253 -1.6027 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1481 0.9660 -0.9310 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