Monomers

2-Methyl-3-phenyl-1-propene

Identifiers

IUPAC name
2-methylprop-2-enylbenzene
InchI
InChI=1S/C10H12/c1-9(2)8-10-6-4-3-5-7-10/h3-7H,1,8H2,2H3
InchI Key
MXTNFIYGTWARIN-UHFFFAOYSA-N
SMILES
CC(=C)Cc1ccccc1
Canonical SMILES
CC(=C)CC1=CC=CC=C1
Isomeric SMILES
CC(=C)CC1=CC=CC=C1
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H12
Heavy Atom Count
10
Molecular Weight
132.206
Exact Molecular Weight
132.0939
Valence Electrons
52
Radical Electrons
0
tPSA
0.0
MolLogP
2.8052
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

 22 22  0  0  0  0  0  0  0  0999 V2000
    2.2214    0.9265   -0.3869 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8699   -0.3882    0.2330 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5189   -0.8108    1.2794 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7847   -1.2007   -0.3490 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5180   -0.4815   -0.3428 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3851   -0.5788    0.7251 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5951    0.0588    0.7872 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9629    0.8482   -0.2938 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1267    0.9746   -1.3838 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9117    0.3104   -1.4018 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5755    1.6979    0.0605 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2871    1.1958   -0.2121 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9969    0.9058   -1.4778 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2794   -1.7532    1.7376 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3276   -0.2404    1.7402 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6401   -2.1594    0.1767 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0276   -1.4734   -1.4115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1048   -1.1918    1.5698 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2713   -0.0342    1.6516 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9279    1.3516   -0.2347 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4524    1.6095   -2.2227 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2730    0.4334   -2.2832 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  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10  5  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  3 14  1  0
  3 15  1  0
  4 16  1  0
  4 17  1  0
  6 18  1  0
  7 19  1  0
  8 20  1  0
  9 21  1  0
 10 22  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers