Monomers
1-Butene
Identifiers
IUPAC name
but-1-ene
InchI
InChI=1S/C4H8/c1-3-4-2/h3H,1,4H2,2H3
InchI Key
VXNZUUAINFGPBY-UHFFFAOYSA-N
SMILES
CCC=C
Canonical SMILES
CCC=C
Isomeric SMILES
CCC=C
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
-1.3989 0.7082 -0.1364 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5041 -0.5330 -0.2701 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6760 -0.2701 0.5778 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8788 -0.2448 0.0477 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5023 0.8638 0.9638 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3550 0.5813 -0.6462 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7879 1.5459 -0.5261 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0765 -1.4409 0.0671 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2038 -0.6353 -1.3406 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5155 -0.1033 1.6268 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7761 -0.0502 0.6624 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9820 -0.4215 -1.0262 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
1 5 1 0
1 6 1 0
1 7 1 0
2 8 1 0
2 9 1 0
3 10 1 0
4 11 1 0
4 12 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers