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
    2.6112   -0.5747   -0.1431 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3978    0.8664    0.1047 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1656    1.5131   -0.3779 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0634    1.0941    0.0788 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7141   -0.0894   -0.0733 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1495   -0.9865   -0.7423 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0359   -0.3731    0.5005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6130    0.5782    1.1987 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7165   -1.6658    0.3186 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4796   -0.8921   -1.1971 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7329   -0.7514    0.0258 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1471   -1.2645    0.5910 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5603    1.0442    1.2019 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2547    1.4059   -0.4210 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2514    2.6194   -0.1013 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2149    1.5633   -1.5084 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5919    0.3725    1.6255 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1333    1.5533    1.3535 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7886   -2.1444    1.3305 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2320   -2.3216   -0.4109 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7773   -1.5469   -0.0215 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