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
    3.5317   -0.4461    0.2716 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4129   -0.6666   -0.3791 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3682    0.2252   -0.3165 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0444   -0.1356   -0.1177 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3877   -1.4347    0.0416 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7353   -1.7211    0.2375 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6686   -0.7022    0.2757 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2118    0.5879    0.1139 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8920    0.8743   -0.0784 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4525    2.2994   -0.2488 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3703   -1.1357    0.2374 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6952    0.4378    0.8869 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3005   -1.5506   -0.9708 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3285   -2.2304    0.0134 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0985   -2.7276    0.3646 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7372   -0.9175    0.4300 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9503    1.3891    0.1445 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4838    2.2634   -0.8697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2105    2.6908    0.7510 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1913    2.9003   -0.7870 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