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
1.4029 -0.0591 -1.5495 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9678 -0.2231 -0.0868 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4227 -0.5908 0.0343 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5725 -0.8945 0.1346 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8119 1.0942 0.7271 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4806 -0.1547 -2.1508 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1377 -0.8129 -1.7925 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7531 0.9825 -1.6785 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3934 0.5816 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5775 -1.1935 0.1988 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4391 -0.3609 0.5673 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9182 -1.9307 -0.2664 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4718 0.8456 1.6862 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2428 1.6310 0.0306 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8339 1.0855 0.5260 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