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
   -3.2001    0.3857   -0.1021 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8849   -0.3202   -0.3034 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7079    0.5868    0.0233 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5430   -0.2287   -0.2156 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7144    0.5051    0.0539 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9278   -0.1415   -0.1303 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8285   -0.1874    0.8332 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3621    0.7027    0.9378 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9998   -0.3346   -0.3515 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2462    1.2655   -0.7870 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8194   -0.6758   -1.3332 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8859   -1.2193    0.3542 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7395    1.4050   -0.7483 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7665    0.9806    1.0444 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5017   -0.6330   -1.2437 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5193   -1.0671    0.5283 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1755   -0.6272   -1.0640 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6242    0.2845    1.7842 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7777   -0.6812    0.7196 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