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
   -0.6492    0.8896   -1.3905 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2712    0.4067   -0.1298 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5541   -0.1912    0.7942 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8744   -0.4399    0.6938 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5191   -1.0512    1.6765 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4111    1.1579   -2.1472 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0072    0.0999   -1.8428 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0446    1.8099   -1.1436 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3317    0.5693   -0.0099 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0833   -0.5248    1.7079 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4003   -0.1220   -0.1862 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5742   -1.2529    1.6395 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9702   -1.3513    2.5321 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