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
   -2.2035    0.4492   -0.2572 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0383   -0.2460    0.3186 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1841    0.0988   -0.0467 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3725   -0.5511    0.4872 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5534   -0.1433    0.0668 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6376   -0.2407   -1.0260 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9989    0.6278    0.5230 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8784    1.4152   -0.7021 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1165   -1.0445    1.0427 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2757    0.9028   -0.7764 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3410   -1.3464    1.2063 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4838   -0.5783    0.4181 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6628    0.6564   -0.6598 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