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
   -3.2125    0.0871    0.0287 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8146    0.6423   -0.1020 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7635   -0.4560   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5760    0.2095   -0.1610 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6455   -0.7207   -0.0998 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9315   -0.1562   -0.2264 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7935   -0.6095   -1.1072 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8811    0.9515    0.2331 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5824   -0.3767   -0.9050 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3304   -0.6128    0.8584 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7220    1.1523   -1.0659 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6556    1.3284    0.7513 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9550   -1.1840   -0.8441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8741   -1.0172    0.9232 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5808    0.8199   -1.0659 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6997    0.8589    0.7531 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2343    0.6671    0.4045 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7652   -0.1531   -1.1743 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5646   -1.4307   -1.7743 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