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
   -1.7857    1.0129    0.8290 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7563    0.4352   -0.5691 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1894   -0.9419   -0.5895 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2071   -1.0503   -0.0903 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1272   -0.2750   -0.8362 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4817   -0.2325   -0.5394 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0174    0.7380    0.1728 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8342    0.7715    1.3257 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9165    2.1150    0.8096 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6601    0.6194    1.4047 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2584    1.1333   -1.2802 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8218    0.3629   -0.9057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8363   -1.5875    0.0374 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2355   -1.3413   -1.6175 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3518   -0.8491    0.9699 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5280   -2.1217   -0.2494 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0732   -1.0560   -0.9350 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4351    1.5499    0.5629 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0727    0.7171    0.3704 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