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
   -1.8527   -0.3991   -0.1931 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0811    0.6134    0.5690 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2346    0.6745    0.5380 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0431   -0.2421   -0.2436 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3590   -0.1828   -0.2760 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9767    0.0263   -1.2306 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8446   -0.5591    0.2762 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3635   -1.3904   -0.2192 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6571    1.3136    1.1630 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7425    1.4337    1.1138 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5440   -1.0014   -0.8204 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8754    0.5695    0.2939 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9771   -0.8560   -0.8516 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