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
   -2.1293    0.9137    0.8106 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4442    0.0000   -0.1541 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1573   -0.6856   -1.0069 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0139   -0.0775   -0.0921 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7016   -0.8839   -0.9317 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0758   -0.9692   -0.8845 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7561   -0.2162    0.0407 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0759    0.6147    0.9118 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7012    0.6831    0.8453 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0832    0.4600    1.8428 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6568    1.8976    0.7558 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2194    1.0057    0.5331 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2587   -0.5698   -0.9910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7545   -1.3602   -1.7298 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2017   -1.4870   -1.6679 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6171   -1.6107   -1.5553 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8533   -0.2611    0.1046 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5845    1.2259    1.6582 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1500    1.3204    1.5103 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