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
   -2.2300    0.3448   -0.1064 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9440   -0.2266   -0.5251 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1582    0.0755    0.1191 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4615   -0.4446   -0.2304 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5208   -0.0963    0.4622 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2947    0.2054    1.0089 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2709    1.4398   -0.3317 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1064   -0.1910   -0.5268 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8979   -0.8922   -1.3574 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0839    0.7649    0.9748 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5697   -1.1163   -1.0556 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5197   -0.4479    0.2538 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4301    0.5846    1.3033 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