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
-1.7762 -0.1860 0.3286 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7543 0.3486 -0.6672 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6246 0.2269 -0.1282 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3597 1.3161 0.0321 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1800 -1.1002 0.2296 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6142 -0.6892 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1296 0.6571 0.9448 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2978 -0.9632 0.9672 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9999 1.3934 -0.9461 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8390 -0.2337 -1.6318 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9996 2.3043 -0.2139 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3702 1.2592 0.4236 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8781 -1.7969 -0.6049 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2867 -1.0941 0.2856 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7119 -1.4424 1.1957 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