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
   -2.0547   -0.0925    0.2441 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8053   -0.9935    0.1286 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3242   -0.4857    0.0114 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5966    0.0862   -0.1205 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7999    1.4228   -0.0922 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7308    0.6694    0.9868 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9235   -0.6469    0.5744 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2524    0.4135   -0.6955 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1060   -2.0381    0.1688 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8781   -1.7639    0.0215 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5518   -0.4273   -0.3805 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9451    2.0504    0.0358 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7771    1.8056   -0.1913 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