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
   -2.2607    0.3254    0.3083 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9656   -0.2905   -0.0735 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1963    0.1719    0.3527 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4394   -0.4664   -0.0495 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6223   -0.0350    0.3544 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8944   -0.4578    0.8015 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1443    1.1415    1.0529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8001    0.7187   -0.5740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0343   -1.1465   -0.7263 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2767    1.0272    1.0057 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3984   -1.3240   -0.7018 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5343   -0.5028    0.0598 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6320    0.8382    1.0164 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