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
   -2.9427    0.7124    0.4283 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5958    0.0696    0.5282 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7939    0.2864   -0.7390 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5652   -0.3654   -0.6300 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3148    0.1628    0.4482 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5846   -0.3618    0.6466 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4522   -0.4540   -0.3519 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9138    1.7538    0.0650 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5806    0.1074   -0.2570 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4367    0.6916    1.4235 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7593   -1.0375    0.6295 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0225    0.3861    1.4215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7044    1.3792   -0.8977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3016   -0.1309   -1.6294 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5029   -1.4524   -0.4883 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1239   -0.0777   -1.5605 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9215   -0.7151    1.6112 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4298   -0.8458   -0.2507 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1562   -0.1088   -1.3479 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