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
   -1.9347    1.0557   -0.5006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7729   -0.4218   -0.3756 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0472   -0.8892    0.8398 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3552   -0.3823    0.9735 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1719   -0.7758   -0.1197 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5033   -0.4235   -0.2123 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9239    0.7492   -0.6275 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6196    1.2463   -1.3558 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4748    1.4629    0.3969 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0180    1.6072   -0.7128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3038   -0.8180   -1.3031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7932   -0.8612   -0.3439 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6396   -0.6529    1.7464 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9931   -1.9976    0.7907 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4461    0.6964    1.1001 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7941   -0.8586    1.8754 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2201   -1.1816    0.0825 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2044    1.4882   -0.9155 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9779    0.9567   -0.6748 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