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
1.0812 1.2599 0.8259 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4938 0.8157 -0.4967 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2549 -0.4555 -0.3791 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1264 -1.4976 -1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4357 -0.6560 0.4948 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4120 0.3729 1.4142 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9275 1.9381 0.5887 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3352 1.8792 1.4051 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2918 0.7882 -1.2433 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2354 1.5921 -0.8433 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3750 -2.4675 -1.0504 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9847 -1.3913 -1.7346 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3833 -0.5210 -0.0917 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4789 -1.7186 0.8622 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4893 0.0613 1.3322 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