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
   -3.0164    0.5282   -0.3532 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5968   -0.2868    0.8329 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3086   -1.0370    0.5782 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2448   -0.1514    0.2835 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0409   -0.5938    0.0122 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2379   -1.8271    0.0360 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1365    0.3372   -0.2923 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9111    1.6361   -0.3133 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4797   -0.2013   -0.5714 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3486    1.5476   -0.0744 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8721    0.0556   -0.8912 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1837    0.5740   -1.0992 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4072   -0.9855    1.1162 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4524    0.3767    1.7295 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5047   -1.7602   -0.2298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0301   -1.5806    1.4962 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7211    2.3151   -0.5379 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9541    2.0754   -0.1176 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6211   -1.2254   -0.1385 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5844   -0.2326   -1.6918 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2785    0.4357   -0.1912 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