Monomers

1,1-Dimethyl-2-acetoxyethylene

Identifiers

IUPAC name
2-methylprop-1-enyl acetate
InchI
InChI=1S/C6H10O2/c1-5(2)4-8-6(3)7/h4H,1-3H3
InchI Key
MNJRLZXXSZEIHD-UHFFFAOYSA-N
SMILES
CC(=COC(=O)C)C
Canonical SMILES
CC(=COC(=O)C)C
Isomeric SMILES
CC(=COC(=O)C)C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C6H10O2
Heavy Atom Count
8
Molecular Weight
114.144
Exact Molecular Weight
114.0681
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.4732
H Bond Acceptors
2
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

 18 17  0  0  0  0  0  0  0  0999 V2000
   -2.6161   -0.7410    0.5875 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3381   -0.2749   -0.0094 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2711   -1.0509   -0.0811 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9343   -0.6558   -0.6278 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9484   -0.0613    0.0864 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7758    0.1410    1.3247 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2434    0.3673   -0.4827 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3157    1.1259   -0.5298 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4845   -0.5275   -0.0768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5393   -1.8480    0.6737 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7420   -0.2626    1.5927 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3520   -2.0514    0.3123 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5152    1.4083   -0.2258 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2656    0.2932   -1.5895 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0697   -0.3135   -0.1215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3595    1.4004   -0.9727 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1016    1.2177   -1.3356 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6327    1.8331    0.2692 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  1  0
  5  6  2  0
  5  7  1  0
  2  8  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  3 12  1  0
  7 13  1  0
  7 14  1  0
  7 15  1  0
  8 16  1  0
  8 17  1  0
  8 18  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers