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
   -1.9769   -0.7702    0.7079 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0267    0.2144    0.1346 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2571   -0.0592    0.0170 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1316    0.9504   -0.5530 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4119    0.6892   -0.6751 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5032   -1.3313    1.5488 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2175   -1.4891   -0.1246 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8909   -0.2914    1.1034 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4425    1.1723   -0.1834 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6062   -1.0214    0.3486 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7668    1.9070   -0.8797 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7886   -0.2817   -0.3448 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0954    1.4269   -1.0995 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