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
   -2.9996   -0.5366   -0.6668 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4363    0.8404   -0.8431 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3060    1.1531    0.0791 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2067    0.2669   -0.0898 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9386    0.3955    0.6760 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9776    1.3361    1.5403 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0886   -0.4824    0.5433 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0362   -1.4468   -0.3499 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2937   -0.3163    1.3769 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9076   -0.5216   -0.0222 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3352   -0.8821   -1.6811 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2795   -1.2775   -0.3051 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0856    1.0040   -1.8816 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2464    1.5632   -0.6514 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6170    1.2087    1.1498 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9247    2.1628   -0.1808 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8797   -2.1069   -0.4617 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1899   -1.6253   -0.9905 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3906   -1.0694    2.1740 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2374   -0.3902    0.7681 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3124    0.7245    1.7931 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