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
   -2.1521   -0.6522    0.1737 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9502   -0.0055   -0.3917 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1806   -0.0301    0.2971 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3943    0.5878   -0.2061 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4812    0.5306    0.5208 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0764   -0.2761   -0.3424 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0260   -1.7503    0.0278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3035   -0.4618    1.2435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0275    0.4722   -1.3570 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2146   -0.5182    1.2579 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3664    1.0742   -1.1601 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3943    0.9852    0.1621 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5043    0.0443    1.4718 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