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
1.8943 0.3542 -0.1093 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4308 0.4690 0.1567 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4247 -0.4751 -0.1853 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8690 -0.3516 0.0823 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2309 -0.6954 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1499 0.9069 -1.0351 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4048 0.8254 0.7545 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0207 1.3500 0.6489 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0550 -1.3599 -0.6735 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1345 0.6673 0.4291 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4953 -0.6144 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1530 -1.0764 0.8976 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