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
   -2.1716   -1.0081    0.5671 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4345    0.1180   -0.0556 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1069    1.0919   -0.5802 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0015    0.0818   -0.0509 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6904   -0.9925    0.5277 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0610   -1.0102    0.5230 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7432    0.0425   -0.0583 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0882    1.1010   -0.6287 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7017    1.1165   -0.6225 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8033   -1.9674    0.1716 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9824   -1.0496    1.6771 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2714   -0.9040    0.4657 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2176    1.1150   -0.5811 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6833    1.9535   -1.0552 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0851   -1.7688    0.9574 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5880   -1.8510    0.9760 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8251    0.0336   -0.0647 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6357    1.9077   -1.0743 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2511    1.9901   -1.0942 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