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
   -2.0894   -0.1180    1.1890 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5462    0.8861    0.1967 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0264    0.2051   -1.0540 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0839   -0.7443   -0.6493 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0790    0.0155   -0.0418 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2587   -0.4117    0.4765 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3518    0.2923    0.2407 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3317   -0.7773    1.6106 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5020    0.4821    2.0399 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8996   -0.6840    0.6638 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3509    1.6004   -0.0297 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7288    1.4359    0.6884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8112   -0.2822   -1.6298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6041    1.0218   -1.6954 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3472   -1.5360   -0.0073 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4391   -1.2739   -1.5755 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3652   -1.3089    1.0826 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3274    1.1905   -0.3492 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3325    0.0066    0.6263 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