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
   -2.6386    0.6262    0.0771 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4161   -0.0367    0.7243 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6682   -0.7196   -0.3994 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5742   -1.4230    0.0965 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4782   -0.5194    0.7090 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0319    0.5426    0.0571 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1824    1.0822    0.4129 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2671    1.5090   -0.4857 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3847    0.9139    0.8372 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0424   -0.1170   -0.6555 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8159    0.7872    1.1367 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6924   -0.7209    1.5265 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3009   -1.4525   -0.9269 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3485    0.0586   -1.1182 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1029   -1.7997   -0.8201 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3748   -2.2962    0.7167 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5016    0.9652   -0.7959 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7241    0.6808    1.2530 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6048    1.9193   -0.1122 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