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
    4.1523   -0.7225    0.0656 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1289    0.0795   -0.1987 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3339    0.6698    0.9067 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8792    0.2579    0.8258 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2377    0.6995   -0.4675 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1784    0.2437   -0.4356 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1959    1.0265    0.0804 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5013    0.5796    0.0980 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8292   -0.6640   -0.4001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8358   -1.4626   -0.9192 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5499   -0.9988   -0.9260 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7243   -1.1470   -0.7396 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4443   -0.9744    1.0677 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8676    0.3082   -1.2247 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4545    1.7701    0.9711 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7236    0.2576    1.8577 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3543    0.7444    1.6640 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8341   -0.8273    0.9874 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7143    0.2754   -1.3539 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2374    1.7988   -0.4976 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9759    2.0022    0.4774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3152    1.1790    0.4989 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8426   -1.0204   -0.3907 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0943   -2.4435   -1.3122 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7681   -1.6317   -1.3365 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