Monomers

N-(4-Bromophenyl)methacrylamide

Identifiers

IUPAC name
N-(4-bromophenyl)-2-methylprop-2-enamide
InchI
InChI=1S/C10H10BrNO/c1-7(2)10(13)12-9-5-3-8(11)4-6-9/h3-6H,1H2,2H3,(H,12,13)
InchI Key
SLCQGECCJKYUCZ-UHFFFAOYSA-N
SMILES
O=C(C(=C)C)Nc1ccc(cc1)Br
Canonical SMILES
CC(=C)C(=O)NC1=CC=C(C=C1)Br
Isomeric SMILES
CC(=C)C(=O)NC1=CC=C(C=C1)Br
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H10BrNO
Heavy Atom Count
13
Molecular Weight
240.1
Exact Molecular Weight
238.9946
Valence Electrons
68
Radical Electrons
0
tPSA
29.1
MolLogP
2.9637
H Bond Acceptors
1
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1

MOL File


     RDKit          3D

 23 23  0  0  0  0  0  0  0  0999 V2000
    0.9159    1.8816   -0.4222 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3095    0.7172   -0.1849 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7602    0.4206   -0.0489 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5820    1.4194   -0.1876 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2069   -0.9590    0.2312 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3506   -0.3051   -0.0496 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0669   -0.1797   -0.1520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8573   -1.3243    0.0077 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2230   -1.2860   -0.0758 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8846   -0.1012   -0.3242 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1180    1.0183   -0.4809 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7511    0.9683   -0.3952 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7831   -0.0061   -0.4478 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.2229    2.4017   -0.3893 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6357    1.2489   -0.0971 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2474   -0.9680    0.5689 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6047   -1.4432    1.0305 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1263   -1.6247   -0.6529 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7716   -1.2719    0.1526 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3360   -2.2632    0.2045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8173   -2.1879    0.0517 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6539    1.9514   -0.6774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2424    1.8932   -0.5313 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  3
  3  5  1  0
  2  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 10 13  1  0
 12  7  1  0
  4 14  1  0
  4 15  1  0
  5 16  1  0
  5 17  1  0
  5 18  1  0
  6 19  1  0
  8 20  1  0
  9 21  1  0
 11 22  1  0
 12 23  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers