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
   -2.7965   -0.0441   -0.1633 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5127   -0.3124   -0.9596 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4333   -0.5993    0.0893 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8628   -0.8725   -0.6547 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9171   -1.1478    0.2206 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3303   -0.2205    1.1740 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7675    0.9730    0.8794 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4914    0.4872    0.7514 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4759    0.5625   -0.8011 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2160   -1.0525    0.0632 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6584   -1.2109   -1.5989 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2660    0.5808   -1.5458 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3463    0.3003    0.7301 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7215   -1.4587    0.7222 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1300    0.0307   -1.2383 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7476   -1.6990   -1.3817 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2710   -0.5435    2.2023 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0712    1.6420    1.6561 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8207    1.2794   -0.1451 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