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
1.8306 0.0751 -0.1387 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6692 -0.5155 0.6504 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6270 -0.1897 0.0548 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4343 -1.1581 -0.3497 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0732 1.2280 -0.1128 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8972 -0.4980 -1.0871 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5283 1.1058 -0.3962 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7281 0.0132 0.4854 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6974 -0.1570 1.7189 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8225 -1.5933 0.6809 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1113 -2.1773 -0.2282 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4126 -0.9489 -0.8003 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9795 1.7560 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4319 1.7864 -0.8264 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1034 1.2732 -0.5110 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