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
Resources
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
1.9360 0.1108 -0.0648 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6731 -0.6441 -0.1346 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5612 0.1404 -0.1284 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6468 1.4597 -0.0661 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8271 -0.6401 -0.1994 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3544 0.2801 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6862 -0.5168 0.5021 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9022 1.0714 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6575 -1.2795 -1.0664 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5979 -1.3931 0.7044 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6054 1.9537 -0.0669 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2154 2.1159 -0.0116 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8296 -1.3518 0.6778 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8298 -1.2796 -1.1036 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7228 -0.0269 -0.0871 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