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
   -1.8970    1.0763    1.2582 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3393   -0.2262    1.7083 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6639   -1.0156    0.6104 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4750   -0.1912    0.0610 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1326   -0.9072   -0.9764 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1966   -0.2994   -1.5879 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0670    0.1651   -2.8001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3921    1.9611    1.6901 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9727    1.1808    1.5113 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7785    1.1757    0.1493 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1650   -0.8167    2.1571 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5914   -0.0632    2.5350 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2137   -1.9363    1.0357 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3836   -1.3030   -0.1596 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2351   -0.0826    0.8753 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1611    0.7671   -0.3537 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1254   -0.2056   -1.0777 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1108    0.0647   -3.3161 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8934    0.6561   -3.3204 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