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
   -1.7644    0.3527    0.5968 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1723   -0.5264   -0.4657 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1128   -0.5959   -0.6891 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0517    0.1842    0.0888 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3566    0.1508   -0.0959 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1687    0.1487    1.5267 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5776    1.4053    0.2980 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8272    0.1423    0.7383 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8760   -1.1192   -1.0581 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4856   -1.2399   -1.4605 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6355    0.8242    0.8604 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7547   -0.4840   -0.8596 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9892    0.7573    0.5199 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