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
    3.5047   -0.0377   -0.4390 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0608   -0.4597   -0.2507 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4282    0.4902    0.7229 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0761    0.2136    0.9972 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8734    0.2408   -0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5044    0.5218   -1.1668 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2853   -0.0404    0.2305 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7027   -0.3389    1.4470 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2754   -0.0001   -0.8729 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0803   -0.8784   -0.8951 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5620    0.8902   -1.0377 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9260    0.1494    0.5615 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0900   -1.4926    0.1917 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5940   -0.4244   -1.2268 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0486    0.5075    1.6406 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5416    1.5198    0.2693 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0180   -0.3837    2.3004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7331   -0.5571    1.6848 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8363    0.5857   -1.7284 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4629   -1.0079   -1.2597 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2208    0.5019   -0.5782 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