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
1.4116 0.3256 -0.1322 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5887 -0.8846 -0.3836 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7247 -0.8234 -0.3547 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3605 0.4838 -0.0648 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1492 1.1445 -0.8322 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4937 0.1085 -0.2126 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2421 0.7213 0.9095 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1387 -1.8040 -0.5887 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3005 -1.7019 -0.5374 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9595 0.3252 0.8801 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0400 0.8268 -0.8742 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6388 1.2781 0.1440 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