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
   -2.1749   -1.0424   -0.5805 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4748    0.1337    0.0270 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1656    1.1465    0.5157 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0033    0.1120    0.0555 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7418    1.1405    0.5915 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1423    1.1185    0.6178 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7976    0.0255    0.0868 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0744   -1.0171   -0.4558 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6929   -0.9654   -0.4668 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2586   -1.0133   -0.3783 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7910   -2.0012   -0.1416 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9985   -1.0146   -1.6760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7733    2.0215    0.9643 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2518    1.0779    0.4525 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2376    1.9971    1.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6698    1.9588    1.0537 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8769   -0.0043    0.1006 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5655   -1.8967   -0.8842 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0930   -1.7768   -0.8901 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