Monomers

5-Phenyl-1-pentene

Identifiers

IUPAC name
pent-4-enylbenzene
InchI
InChI=1S/C11H14/c1-2-3-5-8-11-9-6-4-7-10-11/h2,4,6-7,9-10H,1,3,5,8H2
InchI Key
RURREWSZSUQSNB-UHFFFAOYSA-N
SMILES
C=CCCCc1ccccc1
Canonical SMILES
C=CCCCC1=CC=CC=C1
Isomeric SMILES
C=CCCCC1=CC=CC=C1
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C11H14
Heavy Atom Count
11
Molecular Weight
146.233
Exact Molecular Weight
146.1096
Valence Electrons
58
Radical Electrons
0
tPSA
0.0
MolLogP
3.1953
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

 25 25  0  0  0  0  0  0  0  0999 V2000
    4.3906    0.5944    0.0466 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4229    0.0336   -0.6417 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3876   -0.7618    0.0428 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0449   -0.0882   -0.2512 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0316   -0.8768    0.4338 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3659   -0.3091    0.2120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8631    0.6290    1.0800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1106    1.2047    0.9313 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9163    0.8403   -0.1281 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4180   -0.1034   -1.0028 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1714   -0.6778   -0.8531 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1839    1.1919   -0.3913 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4567    0.4882    1.1427 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3879    0.1560   -1.7026 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5173   -0.6845    1.1600 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3687   -1.8222   -0.2468 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8910   -0.1783   -1.3481 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1396    0.9400    0.1043 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0291   -1.8993   -0.0339 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1916   -1.0498    1.5116 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2438    0.9264    1.9170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4542    1.9459    1.6528 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9014    1.2943   -0.2464 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0699   -0.3754   -1.8301 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8073   -1.4181   -1.5586 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11  6  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  3 15  1  0
  3 16  1  0
  4 17  1  0
  4 18  1  0
  5 19  1  0
  5 20  1  0
  7 21  1  0
  8 22  1  0
  9 23  1  0
 10 24  1  0
 11 25  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers