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
1.8014 0.5888 -0.2227 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8230 -0.5274 0.0087 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5689 -0.0685 0.0733 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9157 1.2060 -0.0606 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6422 -1.0768 0.2992 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8220 0.1189 -0.2738 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6671 1.0609 -1.2338 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7976 1.3623 0.5475 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0880 -0.9982 0.9776 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9163 -1.2305 -0.8421 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1315 1.9332 -0.2245 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9318 1.5711 -0.0174 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1958 -1.1622 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2984 -0.7036 1.1122 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2311 -2.0741 0.5245 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