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
   -2.2416    0.2448   -0.2159 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9324   -0.3549   -0.4625 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1342    0.1386    0.1284 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4683   -0.4126   -0.0747 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5389    0.0710    0.5090 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0855   -0.3508   -0.5869 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3805    0.3326    0.8939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3248    1.2864   -0.6175 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7737   -1.2121   -1.1249 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0225    0.9787    0.7855 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5477   -1.2559   -0.7401 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5039   -0.3758    0.3233 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5230    0.9100    1.1825 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