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
    4.1960    0.2472    0.3717 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1011   -0.4516    0.0971 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3689   -0.3153   -1.1686 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9474    0.1317   -0.9578 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1506   -0.8244   -0.1132 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2170   -0.2828    0.0224 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2210   -0.5871   -0.8642 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5011   -0.0984   -0.7629 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8216    0.7383    0.2657 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8454    1.0709    1.1793 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5542    0.5609    1.0533 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5740    0.9448   -0.3517 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7213    0.1374    1.3013 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7183   -1.1634    0.8391 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3439   -1.2355   -1.7712 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8648    0.4590   -1.7899 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4595    0.2003   -1.9448 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8837    1.1396   -0.4958 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6417   -0.9562    0.8713 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1072   -1.8007   -0.6689 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9374   -1.2624   -1.6830 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2701   -0.3655   -1.4897 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8351    1.1550    0.3877 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0902    1.7395    2.0065 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7855    0.8184    1.7664 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