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
   -2.1936    0.7227    0.9680 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4429   -0.2036    0.1080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1006   -1.1465   -0.5154 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0025   -0.0997   -0.0656 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7302   -0.9406   -0.8291 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1204   -0.8314   -0.9916 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7714    0.1878   -0.3373 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0316    1.0539    0.4465 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6738    0.9231    0.5870 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3885    1.6639    0.3748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1950    0.2936    1.1628 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6724    0.9922    1.9060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1930   -1.1879   -0.3541 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6538   -1.8850   -1.1745 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2974   -1.7626   -1.3727 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6674   -1.5300   -1.6150 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8406    0.2860   -0.4515 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5803    1.8443    0.9462 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1291    1.6197    1.2077 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