Monomers

Benzene, (1-methoxyethenyl)-

Identifiers

IUPAC name
1-methoxyethenylbenzene
InchI
InChI=1S/C9H10O/c1-8(10-2)9-6-4-3-5-7-9/h3-7H,1H2,2H3
InchI Key
SIZDIMDMQQFWLM-UHFFFAOYSA-N
SMILES
COC(=C)c1ccccc1
Canonical SMILES
COC(=C)C1=CC=CC=C1
Isomeric SMILES
COC(=C)C1=CC=CC=C1
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C9H10O
Heavy Atom Count
10
Molecular Weight
134.178
Exact Molecular Weight
134.0732
Valence Electrons
52
Radical Electrons
0
tPSA
9.23
MolLogP
2.3037
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1

MOL File


     RDKit          3D

 20 20  0  0  0  0  0  0  0  0999 V2000
    2.5051   -1.3264    0.5457 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2516   -0.1015    0.0280 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2326    0.6271   -0.4226 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4712    1.7244   -1.1325 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1473    0.2671   -0.1618 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5833   -1.0121    0.0863 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9035   -1.2510    0.3525 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8269   -0.2507    0.3823 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4060    1.0373    0.1355 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0805    1.2999   -0.1343 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9999   -1.6161    1.4905 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6162   -1.3289    0.8346 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4440   -2.2082   -0.1299 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7319    2.3795   -1.5421 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5089    2.0332   -1.3481 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1474   -1.8079    0.0541 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2250   -2.2663    0.5454 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8707   -0.4215    0.5902 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0925    1.8827    0.1439 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7729    2.3393   -0.3175 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  3
  3  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10  5  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  4 14  1  0
  4 15  1  0
  6 16  1  0
  7 17  1  0
  8 18  1  0
  9 19  1  0
 10 20  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers