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
-1.5907 -0.0974 0.2334 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3164 0.0829 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8554 -0.4882 0.0966 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8737 0.2938 0.4098 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8042 -1.1550 0.4282 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5112 0.5272 1.1368 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4133 0.3070 -0.3792 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1767 1.1742 -0.6896 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4482 -0.3089 -1.6201 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8998 -1.5553 0.3424 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7353 -0.1328 0.9043 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8966 1.3528 0.1974 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