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
   -2.2071    0.2875   -0.0251 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0069   -0.4426    0.3782 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1704    0.1440    0.3123 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3982   -0.5230    0.6966 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5453    0.1088    0.6110 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1520   -0.1796    0.2766 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1483    1.3121    0.4464 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1515    0.4243   -1.1415 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0621   -1.4530    0.7297 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2483    1.1675   -0.0410 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3784   -1.5612    1.0622 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5454    1.1254    0.2507 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4419   -0.4101    0.9029 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