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
   -1.7541   -0.7640    0.0964 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1736    0.5986    0.2734 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1164    0.8454    0.1515 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0983   -0.1741   -0.1650 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3544    0.1515   -0.2679 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7181   -0.8518    0.6389 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0345   -0.8459   -0.9875 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0541   -1.5609    0.3992 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8704    1.3883    0.5103 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4537    1.8594    0.2956 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8224   -1.2190   -0.3228 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6725    1.1577   -0.1227 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0871   -0.5852   -0.4996 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