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
   -2.1681    0.5115    0.6844 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0171   -0.3124    0.2753 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2047    0.1669    0.2888 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3525   -0.6425   -0.1151 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5614   -0.1368   -0.0913 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9409    1.5976    0.6000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0427    0.2510    0.0356 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4397    0.2275    1.7211 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1816   -1.3237   -0.0397 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3537    1.1812    0.6066 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2236   -1.6635   -0.4376 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3922   -0.7345   -0.3877 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7019    0.8776    0.2276 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