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
-1.3932 0.7785 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5104 -0.4429 0.0395 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8487 -0.2086 -0.4687 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8891 -0.3812 0.3227 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4165 0.4402 0.2697 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4295 1.1098 -1.0919 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1043 1.5715 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4857 -0.8394 1.0789 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0020 -1.2310 -0.5797 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9662 0.1030 -1.4899 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8752 -0.2036 -0.0716 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7624 -0.6964 1.3540 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