Monomers
beta-Butene
Identifiers
IUPAC name
but-2-ene
InchI
InChI=1S/C4H8/c1-3-4-2/h3-4H,1-2H3
InchI Key
IAQRGUVFOMOMEM-UHFFFAOYSA-N
SMILES
CC=CC
Canonical SMILES
CC=CC
Isomeric SMILES
CC=CC
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H8
Heavy Atom Count
4
Molecular Weight
56.108
Exact Molecular Weight
56.0626
Valence Electrons
24
Radical Electrons
0
tPSA
0.0
MolLogP
1.5824
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
12 11 0 0 0 0 0 0 0 0999 V2000
-1.4768 0.1704 0.3191 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5673 -0.8934 -0.1333 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7245 -0.6970 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3817 0.5997 -0.0953 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6825 0.8630 -0.5216 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4143 -0.2491 0.7555 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0453 0.8018 1.1397 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0016 -1.8705 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3582 -1.5149 -0.6557 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8127 1.3228 0.4803 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3336 0.4145 0.4405 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5770 1.0527 -1.0953 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 3
3 4 1 0
1 5 1 0
1 6 1 0
1 7 1 0
2 8 1 0
3 9 1 0
4 10 1 0
4 11 1 0
4 12 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers