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
   -2.1930    1.1997    0.0364 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4284   -0.1039    0.1254 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1160   -1.1888    0.3038 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0015   -0.1068    0.0146 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6532    1.0777   -0.2059 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0165    1.0720   -0.3094 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7651   -0.0779   -0.2014 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1092   -1.2577    0.0185 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7097   -1.2616    0.1263 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2111    1.0238    0.3587 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6602    1.9608    0.6618 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1972    1.4603   -1.0390 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6552   -2.1451    0.3770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2025   -1.1406    0.3840 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1305    2.0192   -0.3017 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5352    2.0179   -0.4852 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8495   -0.0830   -0.2837 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6438   -2.2107    0.1147 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2524   -2.2552    0.3050 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