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
   -2.1863   -0.9455   -0.6225 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4716    0.1984   -0.0086 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1677    1.2232    0.4085 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0303    0.1196    0.0973 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6604   -1.0083   -0.3692 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0313   -1.1215   -0.2866 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7725   -0.1166    0.2639 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1417    1.0202    0.7406 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7629    1.1075    0.6450 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8539   -1.8716   -0.1143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9267   -0.9348   -1.7083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2868   -0.8629   -0.5102 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2560    1.2796    0.3270 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7023    2.0831    0.8628 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0646   -1.8042   -0.8061 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5523   -1.9925   -0.6481 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8471   -0.1769    0.3421 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7442    1.8044    1.1726 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3047    1.9990    1.0224 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