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
    4.2052    0.2980   -1.6257 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4766    0.6463   -0.5852 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4293   -0.2886   -0.1143 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0429    0.3161   -0.1590 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1108   -0.7603    0.3488 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2904   -0.3585    0.3794 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0456   -0.5953   -0.7515 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3752   -0.2681   -0.8596 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9838    0.3280    0.2205 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2525    0.5838    1.3830 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9175    0.2400    1.4528 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0731   -0.6350   -2.1483 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9947    0.9496   -2.0187 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6643    1.5946   -0.1120 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6427   -0.5135    0.9559 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4257   -1.2414   -0.6481 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0039    1.2315    0.4681 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7358    0.6030   -1.1782 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2270   -1.6375   -0.3157 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5039   -1.0668    1.3442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6040   -1.0702   -1.6426 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9635   -0.4563   -1.7499 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0301    0.6204    0.2241 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7408    1.0491    2.2166 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3325    0.4310    2.3481 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