Monomers

N-Propyl methacrylate

Identifiers

IUPAC name
propyl 2-methylprop-2-enoate
InchI
InChI=1S/C7H12O2/c1-4-5-9-7(8)6(2)3/h2,4-5H2,1,3H3
InchI Key
NHARPDSAXCBDDR-UHFFFAOYSA-N
SMILES
CCCOC(=O)C(=C)C
Canonical SMILES
CCCOC(=O)C(=C)C
Isomeric SMILES
CCCOC(=O)C(=C)C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C7H12O2
Heavy Atom Count
9
Molecular Weight
128.171
Exact Molecular Weight
128.0837
Valence Electrons
52
Radical Electrons
0
tPSA
26.3
MolLogP
1.5157
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

 21 20  0  0  0  0  0  0  0  0999 V2000
    2.9164   -1.0524   -0.5894 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7178    0.3261   -0.0188 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4050    0.9400   -0.4448 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2990    0.1655   -0.0279 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9759    0.6029   -0.3462 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0583    1.6912   -1.0036 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1682   -0.1374    0.0464 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0153   -1.2523    0.7228 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4989    0.3752   -0.3197 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4486   -0.9796   -1.5655 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4900   -1.6599    0.1345 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8873   -1.4804   -0.7402 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7898    0.2608    1.0861 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5611    0.9664   -0.3430 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3265    1.9120    0.1259 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3908    1.2121   -1.5013 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0232   -1.5875    0.9674 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8881   -1.8064    1.0175 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1898   -0.4791   -0.4613 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4829    0.9415   -1.2637 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9318    1.0413    0.4644 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  2  0
  5  7  1  0
  7  8  2  3
  7  9  1  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  2 14  1  0
  3 15  1  0
  3 16  1  0
  8 17  1  0
  8 18  1  0
  9 19  1  0
  9 20  1  0
  9 21  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers