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
   -0.6113    1.9964   -0.3639 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1600    0.9043   -0.0841 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6218    0.8473    0.0695 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3084    1.9431   -0.0911 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2733   -0.4159    0.3947 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3948   -0.2755    0.0862 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0051   -0.3410   -0.0300 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8601    0.7173   -0.0784 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2472    0.5273   -0.2134 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7852   -0.7353   -0.3004 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9445   -1.8167   -0.2535 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6023   -1.6081   -0.1224 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6728   -0.9800   -0.4836 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -4.3832    1.9940    0.0027 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8271    2.9005   -0.3363 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1735   -1.1552   -0.4481 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3313   -0.2377    0.6509 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7805   -0.9332    1.2664 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9465   -1.1779    0.3248 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4833    1.7324   -0.0024 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8756    1.4098   -0.2463 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3844   -2.8136   -0.3234 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9510   -2.4823   -0.0873 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