Monomers

Methyl 2-ethylacrylate

Identifiers

IUPAC name
methyl 2-methylidenebutanoate
InchI
InChI=1S/C6H10O2/c1-4-5(2)6(7)8-3/h2,4H2,1,3H3
InchI Key
JKJJSJJGBZXUQV-UHFFFAOYSA-N
SMILES
CCC(=C)C(=O)OC
Canonical SMILES
CCC(=C)C(=O)OC
Isomeric SMILES
CCC(=C)C(=O)OC
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
1.1256
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
   -2.4644   -1.2584    0.6601 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1006   -1.2944    0.0193 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3942    0.0210    0.1798 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9567    1.0262    0.8097 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9469    0.1074   -0.4056 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4848   -0.8541   -1.0082 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7033    1.2791   -0.3212 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9964    1.3730   -0.8818 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1060   -0.4667    0.2390 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9016   -2.2604    0.5865 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3134   -1.0304    1.7438 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1321   -1.6035   -1.0368 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4903   -2.0407    0.5749 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4495    1.9611    0.9214 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9384    0.9042    1.2166 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7156    1.0098   -0.1129 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1240    0.7349   -1.7794 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2762    2.3918   -1.1537 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  3
  3  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  2 13  1  0
  4 14  1  0
  4 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