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
   -2.6153    0.3920    0.4064 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4917   -0.5217   -0.0344 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4966    0.3017   -0.7834 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6848   -0.4978   -1.2823 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3956   -1.1061   -0.2284 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9916   -0.4026    0.7967 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9986    0.4229    0.6343 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4252    0.6977    1.4708 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6458    1.2804   -0.2542 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5920   -0.1541    0.4343 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0319   -1.0030    0.8357 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9359   -1.3224   -0.6703 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0874    1.0606   -0.0743 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9604    0.8722   -1.6047 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4220   -1.2299   -2.0627 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3860    0.2527   -1.7478 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5868   -0.5569    1.7875 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4207    0.9422    1.4696 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3960    0.5722   -0.3499 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