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
    2.5117    0.9801   -0.0163 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3410   -0.4941   -0.3016 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4317   -1.1323    0.7484 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1612   -0.5574    0.7719 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7200   -0.5316   -0.2976 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3361   -1.0691   -1.3641 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0339    0.0767   -0.2333 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7931    0.0465   -1.3075 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5688    0.7332    0.9837 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0952    1.6201   -0.8190 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9936    1.2499    0.9448 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5914    1.2244    0.0938 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9726   -0.7081   -1.3116 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3337   -1.0004   -0.2080 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9122   -0.9302    1.7321 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4317   -2.2151    0.5253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7845    0.4887   -1.3077 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4086   -0.4380   -2.2189 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7593    1.1258    1.6445 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1275   -0.0191    1.5784 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2442    1.5501    0.6636 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