Monomers

1-Ethenoxy-2-methylbenzene

Identifiers

IUPAC name
1-ethenoxy-2-methylbenzene
InchI
InChI=1S/C9H10O/c1-3-10-9-7-5-4-6-8(9)2/h3-7H,1H2,2H3
InchI Key
TWWWGBSUPNNTMJ-UHFFFAOYSA-N
SMILES
C=COc1ccccc1C
Canonical SMILES
CC1=CC=CC=C1OC=C
Isomeric SMILES
CC1=CC=CC=C1OC=C
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
2.5173
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
    3.3754   -0.9116    0.4229 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3167   -0.7618   -0.3352 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4128    0.3001   -0.1514 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0646   -0.0216   -0.1282 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3707   -1.3374   -0.2803 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7269   -1.6258   -0.2524 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6141   -0.5834   -0.0720 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1976    0.7251    0.0800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8342    1.0086    0.0511 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3411    2.3761    0.2072 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6053   -0.2238    1.2285 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0449   -1.7364    0.2528 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1553   -1.4942   -1.1228 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3498   -2.1336   -0.4202 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0401   -2.6555   -0.3727 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6727   -0.8180   -0.0514 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8881    1.5546    0.2228 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1368    3.0279    0.6375 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5607    2.4516    0.8458 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0631    2.8592   -0.7618 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
  9  4  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  5 14  1  0
  6 15  1  0
  7 16  1  0
  8 17  1  0
 10 18  1  0
 10 19  1  0
 10 20  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers