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
1.7662 -0.4340 0.0505 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6754 0.4140 0.6676 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6074 0.3108 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1799 1.3667 -0.5815 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2953 -0.9954 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4438 -0.9396 -0.8775 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1362 -1.2233 0.7357 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6347 0.2417 -0.1369 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5943 0.0782 1.7414 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9821 1.4940 0.7488 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1223 1.3305 -1.1122 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6865 2.3228 -0.4906 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9536 -1.0248 -1.0757 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5166 -1.7860 -0.2146 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8710 -1.1556 0.7650 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