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
   -1.7943    1.2687   -0.3918 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8278   -0.0582    0.2821 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1052   -1.1431   -0.4634 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3392   -0.8339   -0.6585 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0363   -0.6650    0.5785 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3945   -0.3729    0.4909 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8262    0.8474    0.6236 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8768    1.8196   -0.0398 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6710    1.8856   -0.0368 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7457    1.2378   -1.4838 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8656   -0.4228    0.4657 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3343    0.0325    1.2798 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1600   -2.0621    0.1882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5476   -1.4162   -1.4162 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8172   -1.7267   -1.1497 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4147    0.0676   -1.2985 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0716   -1.1906    0.3102 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1481    1.6715    0.8053 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8807    1.0609    0.5537 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