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
   -2.0626   -0.7505    0.4473 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9135   -0.4868   -0.4376 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1585    0.1054    0.0157 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3204    0.3818   -0.8428 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3850    0.9798   -0.3566 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5371    0.2134    0.7419 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7409   -1.3122    1.3649 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8530   -1.3251   -0.0822 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9262   -0.7749   -1.4805 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2099    0.4105    1.0589 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3261    0.1035   -1.8798 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2335    1.1864   -0.9658 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4000    1.2686    0.6857 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