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
    4.0592   -0.0652    1.2620 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0826    0.1522    0.3878 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4581   -0.9737   -0.3293 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9734   -1.1145   -0.0729 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2856    0.1380   -0.5172 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1742    0.1014   -0.3128 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9704   -0.3851   -1.3236 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3446   -0.4462   -1.1954 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9274   -0.0082   -0.0250 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1603    0.4852    1.0084 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7886    0.5307    0.8430 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5495    0.7241    1.8133 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3798   -1.0707    1.4324 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7643    1.1811    0.2198 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9445   -1.9244   -0.0265 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6494   -0.8877   -1.4320 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8207   -1.2343    1.0327 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5663   -2.0013   -0.5916 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7604    1.0005    0.0052 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4798    0.2452   -1.6156 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5809   -0.7446   -2.2665 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9964   -0.8258   -1.9780 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0140   -0.0572    0.0750 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6360    0.8300    1.9332 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1809    0.9266    1.6736 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