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
   -2.5224    0.6623    0.1923 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9729   -0.4084   -0.6840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7045   -1.0315   -0.1666 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4179   -0.0574   -0.0034 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5406   -0.7676    0.4852 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7502   -0.1381    0.7423 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2931    0.6917   -0.1254 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2155    1.6883   -0.1117 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2302    0.4553    1.2611 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6310    0.6463    0.1158 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8311   -0.0478   -1.7127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7282   -1.2316   -0.7467 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8747   -1.5240    0.8109 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4041   -1.8248   -0.8820 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1437    0.7262    0.7363 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7161    0.4397   -0.9407 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2117   -0.3715    1.6910 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2297    1.1866    0.0603 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8116    0.9063   -1.0632 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