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
   -2.0286    0.4645   -1.2801 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8921   -0.3030   -0.0127 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8664   -0.1830    0.8728 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7499   -1.1684    0.2927 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5447   -0.4783    0.3119 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2635   -0.3941   -0.8632 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4882    0.2428   -0.9083 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0458    0.8210    0.2147 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3344    0.7411    1.3918 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1222    0.1051    1.4140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4131    1.4821   -1.0039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8399    0.0186   -1.9189 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0977    0.5165   -1.8608 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8389   -0.7155    1.8285 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7282    0.4408    0.6965 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8922   -1.6549    1.2770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7118   -1.9515   -0.5189 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8924   -0.8225   -1.7836 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0101    0.2746   -1.8781 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0113    1.3150    0.1475 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7728    1.2004    2.2932 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5735    0.0486    2.3421 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