Monomers

2-Vinylbenzofuran

Identifiers

IUPAC name
2-ethenyl-1-benzofuran
InchI
InChI=1S/C10H8O/c1-2-9-7-8-5-3-4-6-10(8)11-9/h2-7H,1H2
InchI Key
HVFZVIHIJNLIED-UHFFFAOYSA-N
SMILES
C=Cc1cc2c(o1)cccc2
Canonical SMILES
C=CC1=CC2=CC=CC=C2O1
Isomeric SMILES
C=CC1=CC2=CC=CC=C2O1
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H8O
Heavy Atom Count
11
Molecular Weight
144.173
Exact Molecular Weight
144.0575
Valence Electrons
54
Radical Electrons
0
tPSA
13.14
MolLogP
3.0758
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
1
Aliphatic Rings
0
Aromatic Rings
2

MOL File


     RDKit          3D

 19 20  0  0  0  0  0  0  0  0999 V2000
    3.7010   -0.6594   -0.1524 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9328    0.3326    0.2322 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4804    0.2971    0.1799 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7598   -0.8074   -0.2892 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5571   -0.4154   -0.1637 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5921    0.8666    0.3582 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6495    1.2432    0.5440 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8022    1.5135    0.5905 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9777    0.8743    0.2992 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9735   -0.4103   -0.2245 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7620   -1.0325   -0.4467 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2325   -1.5530   -0.5290 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7711   -0.5958   -0.0986 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4099    1.2218    0.6072 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1140   -1.7404   -0.6605 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8492    2.5118    0.9963 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9398    1.3264    0.4585 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9099   -0.9307   -0.4611 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6875   -2.0424   -0.8566 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  6  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
  7  3  1  0
 11  5  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  4 15  1  0
  8 16  1  0
  9 17  1  0
 10 18  1  0
 11 19  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers