Monomers

alpha-Methylstyrene

Identifiers

IUPAC name
prop-1-en-2-ylbenzene
InchI
InChI=1S/C9H10/c1-8(2)9-6-4-3-5-7-9/h3-7H,1H2,2H3
InchI Key
XYLMUPLGERFSHI-UHFFFAOYSA-N
SMILES
CC(=C)c1ccccc1
Canonical SMILES
CC(=C)C1=CC=CC=C1
Isomeric SMILES
CC(=C)C1=CC=CC=C1
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C9H10
Heavy Atom Count
9
Molecular Weight
118.179
Exact Molecular Weight
118.0783
Valence Electrons
46
Radical Electrons
0
tPSA
0.0
MolLogP
2.7197
H Bond Acceptors
0
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

 19 19  0  0  0  0  0  0  0  0999 V2000
   -2.3565   -0.6729   -0.3314 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4114    0.3920    0.1720 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8753    1.4899    0.6815 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0175    0.1091    0.0494 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4568   -1.0849   -0.5052 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7784   -1.3418   -0.6164 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7515   -0.4670   -0.2015 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3202    0.7185    0.3491 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9611    1.0112    0.4768 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3902   -0.4291   -0.0141 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0925   -1.6378    0.1067 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3400   -0.7307   -1.4236 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2501    2.2741    1.0518 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9554    1.6910    0.7683 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2942   -1.8022   -0.8450 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1365   -2.2750   -1.0497 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8224   -0.6865   -0.2969 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0446    1.4629    0.7014 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6767    1.9794    0.9270 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  3
  2  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9  4  1  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  3 13  1  0
  3 14  1  0
  5 15  1  0
  6 16  1  0
  7 17  1  0
  8 18  1  0
  9 19  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers