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
    2.5414    0.9058   -0.6255 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3376   -0.5232   -0.2568 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4842   -0.7250    0.9608 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1983   -0.2171    0.8652 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7391   -0.6104   -0.0840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3523   -1.4907   -0.8933 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0802   -0.0489   -0.1470 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8935   -0.4866   -1.0816 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5602    0.9866    0.7918 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2611    1.0779   -1.6995 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0066    1.6258    0.0089 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6310    1.1683   -0.5685 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9582   -1.0950   -1.1405 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3298   -1.0078   -0.0215 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5227   -1.8180    1.2044 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9950   -0.2199    1.8078 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5886   -1.2502   -1.7999 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8938   -0.0689   -1.1299 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3585    1.6216    0.3280 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7531    1.6512    1.1457 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0465    0.5246    1.6968 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