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
   -1.2751    0.6813    1.5847 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8085   -0.5037    0.6490 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0389   -0.5133   -0.0980 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0563   -0.5270   -1.1610 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7255    0.6148   -1.3782 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1183    1.0916    0.9938 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6552    0.2577    2.4998 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4318    1.3666    1.7318 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5140   -1.3743    0.9741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2498   -1.8622   -0.4509 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3504   -1.3515   -1.7435 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4428    1.4745   -0.7833 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5167    0.6456   -2.1408 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