Monomers

Benzenemethanamine, 4-ethenyl-N,N-dimethyl-

Identifiers

IUPAC name
1-(4-ethenylphenyl)-N,N-dimethylmethanamine
InchI
InChI=1S/C11H15N/c1-4-10-5-7-11(8-6-10)9-12(2)3/h4-8H,1,9H2,2-3H3
InchI Key
XQBHAZDVLGNSOJ-UHFFFAOYSA-N
SMILES
C=Cc1ccc(cc1)CN(C)C
Canonical SMILES
CN(C)CC1=CC=C(C=C1)C=C
Isomeric SMILES
CN(C)CC1=CC=C(C=C1)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C11H15N
Heavy Atom Count
12
Molecular Weight
161.248
Exact Molecular Weight
161.1204
Valence Electrons
64
Radical Electrons
0
tPSA
3.24
MolLogP
2.3912
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1

MOL File


     RDKit          3D

 27 27  0  0  0  0  0  0  0  0999 V2000
    4.4356   -1.0002    0.6876 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7731    0.0829    0.3590 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3681    0.0288   -0.0028 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6318   -1.1198   -0.0325 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2808   -1.1086   -0.3894 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3824    0.0470   -0.7288 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3678    1.2042   -0.6967 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6986    1.2149   -0.3482 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7965    0.0569   -1.1021 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7120    0.2358   -0.0400 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5977    1.4328    0.7021 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0888   -0.9267    0.6791 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4991   -0.9708    0.9631 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9883   -1.9659    0.7077 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2945    1.0277    0.3614 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0770   -2.0838    0.2222 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3045   -2.0285   -0.4120 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1312    2.1447   -0.9622 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2935    2.1248   -0.3216 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0926   -0.8659   -1.6662 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9640    0.8924   -1.8437 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6000    1.6460    1.1768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4282    2.2756    0.0056 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8239    1.4308    1.4934 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2166   -0.9914    0.6507 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8287   -0.9229    1.7518 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7411   -1.8607    0.1929 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  6  9  1  0
  9 10  1  0
 10 11  1  0
 10 12  1  0
  8  3  1  0
  1 13  1  0
  1 14  1  0
  2 15  1  0
  4 16  1  0
  5 17  1  0
  7 18  1  0
  8 19  1  0
  9 20  1  0
  9 21  1  0
 11 22  1  0
 11 23  1  0
 11 24  1  0
 12 25  1  0
 12 26  1  0
 12 27  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers