Monomers

Butyl vinyl ether

Identifiers

IUPAC name
1-ethenoxybutane
InchI
InChI=1S/C6H12O/c1-3-5-6-7-4-2/h4H,2-3,5-6H2,1H3
InchI Key
UZKWTJUDCOPSNM-UHFFFAOYSA-N
SMILES
CCCCOC=C
Canonical SMILES
CCCCOC=C
Isomeric SMILES
CCCCOC=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C6H12O
Heavy Atom Count
7
Molecular Weight
100.161
Exact Molecular Weight
100.0888
Valence Electrons
42
Radical Electrons
0
tPSA
9.23
MolLogP
1.9466
H Bond Acceptors
1
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

 19 18  0  0  0  0  0  0  0  0999 V2000
   -2.9303    0.4414    0.0608 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8431   -0.0809   -0.8409 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5138   -0.1589   -0.1158 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5491   -0.6861   -1.0511 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7882   -0.7669   -0.4018 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4495    0.3049    0.1538 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6256    0.1138    0.7258 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7407    0.1312    1.1236 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9575    1.5664    0.0426 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8993    0.1096   -0.3202 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7310    0.6062   -1.7175 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0887   -1.0899   -1.2394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6377   -0.8493    0.7340 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2081    0.8160    0.2738 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5700   -0.0957   -1.9813 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2728   -1.7312   -1.3684 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0457    1.3153    0.1448 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0690   -0.8646    0.7615 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1804    0.9189    1.1732 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  3
  1  8  1  0
  1  9  1  0
  1 10  1  0
  2 11  1  0
  2 12  1  0
  3 13  1  0
  3 14  1  0
  4 15  1  0
  4 16  1  0
  6 17  1  0
  7 18  1  0
  7 19  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers