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
   -2.0563   -1.3735   -0.0364 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4945    0.0375   -0.0648 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2737    1.0666   -0.1372 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0489    0.1219   -0.0050 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5821    1.3382   -0.0235 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9841    1.3955    0.0355 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7740    0.2742    0.1122 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1286   -0.9362    0.1298 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7598   -1.0200    0.0733 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6289   -1.8661    0.8515 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6194   -1.8719   -0.9253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1573   -1.3573   -0.0412 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3522    0.9099   -0.1783 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9129    2.0678   -0.1590 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0287    2.2851   -0.0833 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4549    2.3624    0.0195 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8575    0.3741    0.1557 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7148   -1.8309    0.1891 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2595   -1.9774    0.0877 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