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

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
   -2.8356    0.6891   -0.6333 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1406    0.2462    0.4923 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0985   -0.6883    0.3469 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4330   -1.9513    0.2963 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2614   -0.2012    0.2633 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5311    1.1666    0.3259 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8194    1.6478    0.2480 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8905    0.8073    0.1060 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6319   -0.5468    0.0433 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3359   -1.0326    0.1216 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3491   -0.1276   -1.1953 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1577    1.1718   -1.3877 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5603    1.4707   -0.2850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7030   -2.7407    0.1861 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4584   -2.2934    0.3609 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3094    1.8443    0.4385 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9766    2.7270    0.3020 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9145    1.1708    0.0429 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4667   -1.2417   -0.0698 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2173   -2.1178    0.0640 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