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
   -2.0028    0.4594   -0.0655 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0120    0.5209   -1.2014 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3685    0.8077   -0.7164 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0391    1.8747   -1.1087 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0196   -0.1013    0.2190 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1783    0.0945    0.6563 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3644   -1.2359    0.6645 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0034   -2.0923    1.5585 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6869    1.0798    0.7992 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0965   -0.5920    0.2746 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9969    0.7849   -0.4321 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9834   -0.4632   -1.6794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3328    1.3351   -1.8884 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0363    2.0689   -0.7497 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6180    2.5914   -1.8009 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5842   -3.1166    1.4222 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0921   -2.1819    1.4116 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8074   -1.8342    2.6366 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