Monomers

2,3-Dimethyl-1,3-butadiene

Identifiers

IUPAC name
2,3-dimethylbuta-1,3-diene
InchI
InChI=1S/C6H10/c1-5(2)6(3)4/h1,3H2,2,4H3
InchI Key
SDJHPPZKZZWAKF-UHFFFAOYSA-N
SMILES
CC(=C)C(=C)C
Canonical SMILES
CC(=C)C(=C)C
Isomeric SMILES
CC(=C)C(=C)C
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C6H10
Heavy Atom Count
6
Molecular Weight
82.146
Exact Molecular Weight
82.0783
Valence Electrons
34
Radical Electrons
0
tPSA
0.0
MolLogP
2.1386
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

 16 15  0  0  0  0  0  0  0  0999 V2000
    1.8008    0.0339    0.7125 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6500    0.0514   -0.2279 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9108    0.1777   -1.5323 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7097   -0.0653    0.2616 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8878   -0.1861    1.5587 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7983   -0.0401   -0.7327 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7366   -0.0445    0.1430 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7974    1.0049    1.2437 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6791   -0.8090    1.4261 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0544    0.1878   -2.1989 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9281    0.2640   -1.8873 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0748   -0.2018    2.2650 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8821   -0.2745    1.9523 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5920   -0.8102   -1.5002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7878   -0.2614   -0.2925 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8249    0.9733   -1.1911 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  3
  2  4  1  0
  4  5  2  3
  4  6  1  0
  1  7  1  0
  1  8  1  0
  1  9  1  0
  3 10  1  0
  3 11  1  0
  5 12  1  0
  5 13  1  0
  6 14  1  0
  6 15  1  0
  6 16  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers