Monomers

N,N-Dimethyl-3-vinylaniline

Identifiers

IUPAC name
3-ethenyl-N,N-dimethylaniline
InchI
InChI=1S/C10H13N/c1-4-9-6-5-7-10(8-9)11(2)3/h4-8H,1H2,2-3H3
InchI Key
PICSCPLZGPFCIT-UHFFFAOYSA-N
SMILES
C=Cc1cccc(c1)N(C)C
Canonical SMILES
CN(C)C1=CC=CC(=C1)C=C
Isomeric SMILES
CN(C)C1=CC=CC(=C1)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H13N
Heavy Atom Count
11
Molecular Weight
147.221
Exact Molecular Weight
147.1048
Valence Electrons
58
Radical Electrons
0
tPSA
3.24
MolLogP
2.3956
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

 24 24  0  0  0  0  0  0  0  0999 V2000
    3.4115    1.4693    0.5446 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8508    0.3448    0.9019 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7310   -0.1386    0.1170 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9105   -0.8169   -1.0706 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8640   -1.2575   -1.8444 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4145   -0.9840   -1.3687 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6518   -0.3117   -0.1919 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4582    0.1112    0.5517 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9524   -0.0117    0.2668 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7733   -1.0793    0.7852 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3932    1.3802    0.1999 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2417    1.8528    1.1021 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0521    2.0143   -0.2988 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2153   -0.2150    1.7650 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9356   -0.9880   -1.3666 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0451   -1.7950   -2.7774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2753   -1.3072   -1.9340 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2228    0.6334    1.4709 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3046   -1.6024    1.6405 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8582   -1.8322   -0.0369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8018   -0.7101    1.0539 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6804    2.0469    0.7312 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4179    1.5047    0.6091 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4152    1.6918   -0.8502 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
  7  9  1  0
  9 10  1  0
  9 11  1  0
  8  3  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  4 15  1  0
  5 16  1  0
  6 17  1  0
  8 18  1  0
 10 19  1  0
 10 20  1  0
 10 21  1  0
 11 22  1  0
 11 23  1  0
 11 24  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers