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
   -4.5456    0.1512   -0.0157 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3478   -0.7352   -0.3573 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1152    0.1040   -0.1076 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9445   -0.5967   -0.3847 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1162    0.2683   -0.1208 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4266   -0.3516   -0.3745 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4661   -1.5967   -0.8033 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6294    0.4301   -0.1436 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5731    1.6030    0.2609 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9099   -0.1000   -0.3655 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0655    0.6846   -0.1321 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4151    0.4481    1.0655 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4384    1.0797   -0.5939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4944   -0.3746   -0.1556 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3905   -1.6441    0.2520 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3758   -1.0140   -1.4267 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1405    0.4679    0.9468 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1534    0.9536   -0.8290 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0029    1.1446   -0.8009 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0163    0.6509    0.9359 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4077   -2.1105   -1.0091 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5719   -2.1730   -0.9733 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9435    1.7087   -0.5561 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3050    0.7741    0.9473 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9331    0.2275   -0.6512 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