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
   -2.0596   -0.5972    0.8255 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8045   -0.6932    0.0364 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1375    0.2060    0.2503 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3725    0.1479   -0.4959 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3012    1.0568   -0.2663 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0532   -1.3679    1.6431 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1581    0.3917    1.2678 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9089   -0.8223    0.1175 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6883   -1.4844   -0.6861 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0130    0.9918    0.9730 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5015   -0.6441   -1.2262 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2120    0.9858   -0.8401 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1348    1.8292    0.4688 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