Monomers

Methyl 2-(propoxymethyl)prop-2-enoate

Identifiers

IUPAC name
methyl 2-(propoxymethyl)prop-2-enoate
InchI
InChI=1S/C8H14O3/c1-4-5-11-6-7(2)8(9)10-3/h2,4-6H2,1,3H3
InchI Key
OVZWLGCWEYISAY-UHFFFAOYSA-N
SMILES
CCCOCC(=C)C(=O)OC
Canonical SMILES
CCCOCC(=C)C(=O)OC
Isomeric SMILES
CCCOCC(=C)C(=O)OC
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H14O3
Heavy Atom Count
11
Molecular Weight
158.197
Exact Molecular Weight
158.0943
Valence Electrons
64
Radical Electrons
0
tPSA
35.53
MolLogP
1.1422
H Bond Acceptors
3
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

 25 24  0  0  0  0  0  0  0  0999 V2000
   -3.9120    0.7531   -0.3600 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1669   -0.5028    0.0314 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6883   -0.3851   -0.3171 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0881    0.6623    0.3244 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2548    0.7186    0.0586 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0880   -0.3356    0.6556 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6436   -1.2953    1.4255 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5167   -0.3078    0.3666 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2433   -1.1940    0.8635 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1074    0.6598   -0.4365 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4951    0.6223   -0.6711 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2049    1.3707    0.5121 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8545    0.4972   -0.9142 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2485    1.3300   -1.0415 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5439   -1.3693   -0.5735 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3271   -0.7592    1.0947 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1798   -1.3353   -0.3735 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7322   -0.0350   -1.4238 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4587    0.7410   -1.0579 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5925    1.7484    0.4012 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3842   -1.3721    1.6780 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3239   -2.0622    1.8415 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9631    0.0845    0.1790 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8904    1.6772   -0.7119 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7529    0.0886   -1.6102 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  3
  6  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  1  0
  1 12  1  0
  1 13  1  0
  1 14  1  0
  2 15  1  0
  2 16  1  0
  3 17  1  0
  3 18  1  0
  5 19  1  0
  5 20  1  0
  7 21  1  0
  7 22  1  0
 11 23  1  0
 11 24  1  0
 11 25  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers