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
    4.4941    0.1115    0.3171 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4437   -0.4279   -0.2712 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2993   -0.9482    0.5067 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0263   -0.2206    0.1337 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1286   -0.7662    0.9382 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4052   -0.0907    0.6155 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8400    1.0362    1.2839 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0367    1.6402    0.9559 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8482    1.1520   -0.0456 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4190    0.0262   -0.7170 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2233   -0.5830   -0.3944 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5164    0.1737    1.3953 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3250    0.4891   -0.2518 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4360   -0.4831   -1.3520 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1483   -2.0115    0.2381 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5314   -0.8564    1.5899 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8704   -0.3625   -0.9462 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1824    0.8621    0.3316 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1110   -0.6196    2.0201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1670   -1.8613    0.7857 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2277    1.4445    2.0742 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3973    2.5355    1.4762 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7945    1.6196   -0.3136 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0369   -0.3864   -1.5152 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8602   -1.4733   -0.9085 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