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
    0.6601    1.9010    0.5278 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1953    0.8270    0.1725 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6680    0.7236    0.0951 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3755    1.7823    0.4079 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3412   -0.5221   -0.3186 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3739   -0.2753   -0.1506 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0366   -0.3335   -0.1291 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6827   -1.5597   -0.3559 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0544   -1.6669   -0.3528 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8582   -0.5742   -0.1267 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2432    0.6305    0.0964 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8476    0.7349    0.0922 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7588   -0.6714   -0.1123 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.8754    2.6812    0.7068 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4641    1.7968    0.3794 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8028   -0.9055   -1.2170 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2967   -1.3123    0.4733 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3854   -0.3159   -0.5559 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9243   -1.1555   -0.4442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0399   -2.4093   -0.5318 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5242   -2.6320   -0.5319 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8435    1.5307    0.2816 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4736    1.7255    0.2729 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