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
    3.6098   -0.3879   -0.7836 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5167   -0.8715    0.1641 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0558    0.3734    0.9175 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0743    0.1387    1.8384 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0938   -0.3401    1.3862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0015    0.4878    0.6111 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7891    1.7329    0.3089 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2470   -0.1155    0.1318 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4698   -1.3148    0.4129 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1769    0.5820   -0.6118 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3464   -0.1002   -1.0230 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1991   -0.1226   -1.7779 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1535    0.4227   -0.2879 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3542   -1.2090   -0.9704 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8394   -1.6841    0.8143 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6700   -1.2300   -0.4527 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7576    1.1431    0.1975 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9411    0.8102    1.4621 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0854   -1.2680    0.7379 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6680   -0.7553    2.2989 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5466    2.3003   -0.3006 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0273    2.3713    0.5816 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1406    0.5802   -1.3573 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1387   -0.7937   -1.8772 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6660   -0.7497   -0.1806 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