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
   -2.2652   -0.8326    0.6386 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4344    0.1519   -0.1219 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0359    1.0697   -0.8326 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0075    0.1009   -0.0810 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6209   -0.8926    0.6912 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0018   -0.9755    0.7568 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7643   -0.0802    0.0620 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2122    0.9142   -0.7109 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8116    0.9721   -0.7570 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2395   -0.6308    1.7342 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3335   -0.7662    0.3473 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9132   -1.8742    0.4885 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5593    1.8342   -1.4234 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1360    1.0731   -0.8365 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0324   -1.5637    1.2122 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4341   -1.7550    1.3627 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8584   -0.1234    0.0965 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8327    1.6135   -1.2536 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4059    1.7646   -1.3730 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