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
    1.0073    1.6347   -1.2334 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3335    0.6077   -0.5943 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7704    0.3202   -0.3666 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6942    1.1256   -0.8248 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1486   -0.8983    0.3910 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3396   -0.2489   -0.1073 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0635   -0.1185   -0.2416 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8967   -1.0089    0.4528 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2683   -0.9624    0.3771 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9051   -0.0214   -0.3991 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1102    0.8604   -1.0879 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7072    0.8097   -1.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8041    0.0706   -0.5260 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.4397    2.0209   -1.3807 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7231    0.9233   -0.6639 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7928   -0.8764    1.4382 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2063   -1.1316    0.2885 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5840   -1.7491   -0.0918 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7219   -1.0991    0.4272 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4115   -1.7579    1.0705 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9029   -1.6507    0.9147 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5678    1.6220   -1.7146 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1240    1.5281   -1.5777 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