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
    2.0765   -0.6583   -0.6325 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7485    0.0036   -0.7438 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1314   -0.0634    0.2411 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4150    0.5865    0.1122 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2839    0.5174    1.0908 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2191   -1.1305    0.3575 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2491   -1.3894   -1.4644 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8855    0.1072   -0.7212 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4952    0.5476   -1.6395 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1076   -0.6114    1.1590 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6505    1.1222   -0.7836 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2461    0.9898    1.0251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0546   -0.0214    1.9992 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