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
    3.6533    0.0807    0.4079 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2783    0.6883    0.3376 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2864   -0.4542    0.2021 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0058    0.1153    0.1360 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0749   -0.7572    0.0093 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8638   -2.0128   -0.0423 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4211   -0.2258   -0.0629 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4454   -1.0434   -0.1834 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6374    1.2353   -0.0008 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2547    0.5129    1.2315 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6177   -1.0249    0.5104 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1491    0.2731   -0.5848 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0078    1.2095    1.2953 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1877    1.3887   -0.5174 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4655   -0.9558   -0.7651 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3676   -1.1219    1.0567 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2530   -2.1028   -0.2258 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4558   -0.6512   -0.2379 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2250    1.5083   -0.9093 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1907    1.5405    0.9354 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6951    1.7973   -0.0607 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