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
    2.5382    1.4590   -0.2615 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3150    0.1952    0.1863 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2697   -0.6515    0.2868 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6007   -1.9203    0.6098 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1438   -0.3519    0.0931 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5443    0.7522   -0.6144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8967    1.0852   -0.8009 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8656    0.2744   -0.2543 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5096   -0.8425    0.4622 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1500   -1.1384    0.6250 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9383    2.2629    0.2594 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6123    1.7454    0.0371 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4956    1.6132   -1.3807 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6210   -2.2222    0.7732 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8290   -2.6362    0.6951 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2084    1.3869   -1.0519 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1721    1.9689   -1.3678 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9308    0.4973   -0.3759 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2845   -1.4667    0.8835 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9306   -2.0111    1.1961 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