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
1.8113 -0.2502 -0.2499 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7330 0.7644 0.0606 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6204 0.2006 -0.0097 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4847 0.7182 -0.8762 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0834 -0.9245 0.8392 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7798 0.2974 -0.2602 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8618 -0.9300 0.6432 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6264 -0.8197 -1.1669 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9549 1.1250 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8510 1.6180 -0.6072 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2236 1.5469 -1.5366 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5124 0.3480 -0.9838 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4211 -0.5649 1.8522 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3099 -1.7107 0.9556 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9627 -1.4183 0.3820 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