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
   -2.2030    1.3776    0.0705 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7414    0.0090   -0.3959 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3420   -0.1882    0.1374 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2463   -1.5099   -0.2488 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5481   -1.5813    0.3026 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5235   -0.6582   -0.0360 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6684    0.5015    0.5551 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0569    1.2979    0.7817 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5122    2.0273   -0.7765 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4109    1.9317    0.6092 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4242   -0.7478    0.0188 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7974   -0.0579   -1.5007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3642   -0.0934    1.2180 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2752    0.6233   -0.2983 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3782   -2.3166    0.1474 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3162   -1.6489   -1.3455 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1979   -0.9207   -0.8349 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0122    0.7871    1.3515 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4425    1.1675    0.2446 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