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
   -2.3367    0.9189    0.0489 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4461   -0.2724   -0.0083 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0244   -1.4521   -0.0599 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0124   -0.1285   -0.0073 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8848   -1.1779   -0.0632 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2575   -1.0470   -0.0622 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7896    0.2229   -0.0008 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9356    1.3236    0.0576 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5683    1.1566    0.0548 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3606    1.3307    1.0776 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3713    0.6710   -0.2470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9619    1.7284   -0.6158 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4742   -2.3774   -0.1038 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1021   -1.5690   -0.0616 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5147   -2.1958   -0.1127 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9595   -1.8645   -0.1059 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8587    0.3975    0.0036 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3733    2.3121    0.1053 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0773    2.0228    0.1009 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