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
   -1.0763   -1.7579    0.4161 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3379   -0.6046    0.0919 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7578   -0.2048    0.0065 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6953   -1.0735    0.2738 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1182    1.1895   -0.3845 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3061    0.3083   -0.1900 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0786    0.0942   -0.1570 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6694   -1.0855    0.1679 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0615   -1.2459    0.1854 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8934   -0.2053   -0.1287 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3112    0.9997   -0.4610 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9438    1.1437   -0.4744 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8048   -0.3984   -0.1124 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -3.4600   -2.0863    0.5585 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7247   -0.8032    0.2176 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4910    1.9087    0.2047 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0058    1.3721   -1.4644 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1609    1.3979   -0.1007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6676    1.2802   -0.4604 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0997   -1.9409    0.4237 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4876   -2.2198    0.4548 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9467    1.8341   -0.7122 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5050    2.0977   -0.7379 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