Monomers

cis-1,3-Pentadiene

Identifiers

IUPAC name
(3Z)-penta-1,3-diene
InchI
InChI=1S/C5H8/c1-3-5-4-2/h3-5H,1H2,2H3/b5-4-
InchI Key
PMJHHCWVYXUKFD-PLNGDYQASA-N
SMILES
C/C=C\C=C
Canonical SMILES
CC=CC=C
Isomeric SMILES
C/C=C\C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C5H8
Heavy Atom Count
5
Molecular Weight
68.119
Exact Molecular Weight
68.0626
Valence Electrons
28
Radical Electrons
0
tPSA
0.0
MolLogP
1.7485
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 13 12  0  0  0  0  0  0  0  0999 V2000
   -1.9563    0.3722   -0.4303 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9401   -0.7480   -0.1858 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2464   -0.5287    0.0596 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5785   -0.2824    0.3350 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9883    1.0132    0.3848 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3970    0.2525   -1.4252 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4887    1.3579   -0.2608 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7564    0.2525    0.3210 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4313   -1.7314   -0.2677 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4751   -1.9106    0.1363 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4159   -1.0056    0.5300 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2632    1.7580    0.2089 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0023    1.2005    0.5943 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  3
  3  4  1  0
  4  5  2  3
  1  6  1  0
  1  7  1  0
  1  8  1  0
  2  9  1  0
  3 10  1  0
  4 11  1  0
  5 12  1  0
  5 13  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers