Monomers

N-Benzylmaleimide

Identifiers

IUPAC name
1-benzylpyrrole-2,5-dione
InchI
InChI=1S/C11H9NO2/c13-10-6-7-11(14)12(10)8-9-4-2-1-3-5-9/h1-7H,8H2
InchI Key
MKRBAPNEJMFMHU-UHFFFAOYSA-N
SMILES
O=C1C=CC(=O)N1Cc1ccccc1
Canonical SMILES
C1=CC=C(C=C1)CN2C(=O)C=CC2=O
Isomeric SMILES
C1=CC=C(C=C1)CN2C(=O)C=CC2=O
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C11H9NO2
Heavy Atom Count
14
Molecular Weight
187.198
Exact Molecular Weight
187.0633
Valence Electrons
70
Radical Electrons
0
tPSA
37.38
MolLogP
1.1116
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
1
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
1

MOL File


     RDKit          3D

 23 24  0  0  0  0  0  0  0  0999 V2000
    1.7791    0.5947   -2.3402 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1396    0.2667   -1.1729 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3446    0.7265   -0.5068 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4028    0.1819    0.7042 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2437   -0.6729    0.9215 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9357   -1.3560    1.9274 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4606   -0.6055   -0.2731 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2200   -1.2646   -0.5726 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9595   -0.4567   -0.1772 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2227   -0.9816   -0.4128 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3485   -0.2716   -0.0643 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2408    0.9681    0.5221 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9854    1.5308    0.7757 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8812    0.7840    0.4100 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0652    1.4158   -0.9702 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2065    0.3637    1.4084 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1751   -2.2294   -0.0109 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1720   -1.5538   -1.6590 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2894   -1.9727   -0.8818 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3257   -0.6826   -0.2489 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1484    1.5241    0.7952 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8713    2.5032    1.2354 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1280    1.1877    0.5908 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
  7  2  1  0
 14  9  1  0
  3 15  1  0
  4 16  1  0
  8 17  1  0
  8 18  1  0
 10 19  1  0
 11 20  1  0
 12 21  1  0
 13 22  1  0
 14 23  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers