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
    3.6473    0.5913   -1.2384 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3790    0.2790   -0.9644 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7830    0.7006    0.3381 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3133   -0.4768    1.1173 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2477   -1.3057    0.5026 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0280   -0.6234    0.2425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2603   -0.0166   -0.9617 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4651    0.6370   -1.2199 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4626    0.6959   -0.2761 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2173    0.0814    0.9319 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0391   -0.5647    1.2012 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1136    0.3072   -2.1629 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2028    1.1452   -0.4967 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7956   -0.2806   -1.6886 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9765    1.4191    0.0861 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5256    1.2763    0.9272 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0622   -0.1999    2.1726 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2091   -1.1580    1.2334 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0389   -2.1570    1.1794 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6225   -1.7346   -0.4510 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5388   -0.0021   -1.7896 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6290    1.1141   -2.1866 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4125    1.1986   -0.4494 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0073    0.1215    1.6950 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8575   -1.0478    2.1632 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