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
    3.6369   -0.5533    0.8080 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4486    0.3788    1.0446 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4979    0.2968   -0.1020 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9938   -0.9877   -0.2885 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1083   -1.0298   -1.3681 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0459   -0.1270   -1.1685 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2457    0.8362   -2.0357 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9590   -0.2785   -0.0431 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7993   -1.2018    0.8213 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0449    0.5531    0.1646 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9203    0.3802    1.2745 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5352   -0.1945    1.3226 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7743   -0.5601   -0.3131 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4194   -1.5828    1.1773 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9609    0.1626    2.0122 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8681    1.4029    1.0747 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9405    0.7309   -1.0078 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6124    0.9433    0.1512 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7027   -0.7323   -2.2562 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2895   -2.0532   -1.5163 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0833    1.5383   -1.9433 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5651    0.9410   -2.8653 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5375    0.9195    2.1593 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1379   -0.6775    1.4686 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8706    0.8949    0.9833 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