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
   -1.7513    1.3113   -1.5704 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5692   -0.1848   -1.4860 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0430   -0.6162   -0.1347 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3000    0.0115    0.1668 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7122   -0.4406    1.4333 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8983   -0.0739    2.0412 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9652   -0.8485    1.9506 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4967    1.5121   -2.3781 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8055    1.8079   -1.9151 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1482    1.7596   -0.6478 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8717   -0.5211   -2.2519 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5417   -0.6754   -1.6463 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7639   -0.4326    0.6838 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8833   -1.7211   -0.2002 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2571    1.1128    0.0888 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0397   -0.4039   -0.5767 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9203    0.8625    2.5890 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8597   -0.5051    2.4477 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9219   -1.7672    1.4060 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