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
1.7730 -0.2667 -0.0194 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4979 -0.5826 -0.7994 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6139 0.1481 -0.1515 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3345 1.0462 -0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9533 -0.1153 1.2642 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6025 -0.2970 -0.7599 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6815 0.7455 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8555 -1.0130 0.7755 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3086 -1.6935 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5900 -0.3075 -1.8667 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0981 1.2452 -1.8188 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1452 1.5896 -0.3479 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7971 -0.8570 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0950 -0.4928 1.8525 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2719 0.8508 1.7233 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