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
-1.7115 -0.5417 0.1863 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6389 0.3606 0.7482 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5857 0.3661 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9740 1.5093 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2887 -0.9169 -0.3107 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6461 -0.3229 0.7418 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8519 -0.3549 -0.9124 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4514 -1.5874 0.3559 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3254 -0.1036 1.7256 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9985 1.3635 0.9904 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4389 2.4230 -0.4401 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8558 1.5450 -1.2317 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5920 -1.0128 -1.3787 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2315 -0.9565 0.2761 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6570 -1.7709 -0.0366 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