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
1.7561 -0.1152 0.4816 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8059 -0.0456 -0.7066 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5895 0.1799 -0.2636 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2458 1.2494 -0.6632 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2900 -0.7744 0.6325 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1682 -0.1788 1.4337 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3524 -1.0626 0.3571 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4661 0.7375 0.4914 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8142 -0.9818 -1.2947 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1877 0.7489 -1.3657 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2677 1.4764 -0.3778 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7136 1.9298 -1.3158 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0707 -0.5857 1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9840 -1.8239 0.3662 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3894 -0.7541 0.5179 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