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
-1.7482 0.0747 -0.4255 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5700 -0.8553 -0.2164 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6860 -0.1185 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7108 -0.2686 -0.7739 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7690 0.7841 1.2134 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1802 0.4101 0.5499 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4963 -0.4838 -1.0249 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4564 0.9599 -1.0318 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8186 -1.5065 0.6453 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4553 -1.4323 -1.1468 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6629 0.2388 -0.6505 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6252 -0.9281 -1.6179 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7902 0.8184 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4873 1.8116 0.8389 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0066 0.4956 1.9580 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