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
   -2.2490    0.6145   -0.0312 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7776   -0.6703    0.5665 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6565   -1.3151   -0.1921 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5720   -0.4602   -0.2893 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0853   -0.1501    1.0147 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2132    0.6258    1.1841 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8650    1.1951    0.2013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4306    1.2760   -0.3744 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9542    0.4110   -0.8729 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8259    1.1879    0.7303 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5077   -0.5093    1.6261 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6304   -1.3801    0.5635 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3700   -2.2385    0.3647 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0017   -1.5449   -1.2169 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3708   -1.1039   -0.7512 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4506    0.4347   -0.8985 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5489    0.7467    2.2170 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7391    1.7871    0.4157 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5586    1.0936   -0.8205 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