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
    2.2430   -1.0428   -0.0701 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4407    0.2180   -0.2013 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0162    1.3617   -0.4625 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0036    0.1413   -0.0312 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8189    1.2405   -0.1319 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1923    1.0965    0.0429 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7549   -0.1280    0.3165 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9011   -1.2076    0.4104 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5532   -1.1097    0.2464 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0541   -1.4138    0.9584 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3201   -0.8156   -0.1668 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8907   -1.8199   -0.7811 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4794    2.2656   -0.5608 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0896    1.3862   -0.5839 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4192    2.2377   -0.3483 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8395    1.9756   -0.0388 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8314   -0.2383    0.4531 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3387   -2.1776    0.6262 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1117   -1.9700    0.3229 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