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
1.9065 -0.0650 -0.0096 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6453 0.7240 -0.2954 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5708 -0.0624 0.0373 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4296 -1.2773 0.5119 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9468 0.5077 -0.1599 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9574 -0.9794 -0.6078 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9658 -0.3150 1.0839 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8170 0.5172 -0.2333 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6129 0.9000 -1.3974 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6701 1.6748 0.2754 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3032 -1.8492 0.7536 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5401 -1.7040 0.6606 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6955 -0.2780 -0.0578 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1155 1.2583 0.6157 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0537 0.9482 -1.1771 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