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
    3.1667   -0.8676    0.0956 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8160   -0.3165   -0.1388 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6880    0.7790   -0.8559 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6407   -0.9960    0.4294 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6321   -0.3116    0.0986 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1467    0.6685    0.9180 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3285    1.3240    0.6380 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0503    1.0093   -0.5019 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5436    0.0333   -1.3235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3686   -0.6158   -1.0416 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1657   -1.9666   -0.1043 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9559   -0.3368   -0.4703 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3814   -0.7441    1.1959 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7133    1.2417   -1.0683 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5369    1.3053   -1.2900 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5582   -2.0595    0.0630 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7831   -1.0732    1.5317 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5774    0.9185    1.8195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7193    2.0993    1.3024 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9763    1.5210   -0.7239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0908   -0.2236   -2.2125 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9723   -1.3885   -1.6969 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