Monomers
n,n-Divinylaniline
Identifiers
IUPAC name
N,N-bis(ethenyl)aniline
InchI
InChI=1S/C10H11N/c1-3-11(4-2)10-8-6-5-7-9-10/h3-9H,1-2H2
InchI Key
ZARXZEARBRXKMO-UHFFFAOYSA-N
SMILES
C=CN(c1ccccc1)C=C
Canonical SMILES
C=CN(C=C)C1=CC=CC=C1
Isomeric SMILES
C=CN(C=C)C1=CC=CC=C1
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C10H11N
Heavy Atom Count
11
Molecular Weight
145.205
Exact Molecular Weight
145.0891
Valence Electrons
56
Radical Electrons
0
tPSA
3.24
MolLogP
2.78
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
22 22 0 0 0 0 0 0 0 0999 V2000
-1.9864 -2.2073 -0.6089 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6745 -1.4584 0.4161 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0721 -0.1671 0.3332 N 0 0 0 0 0 0 0 0 0 0 0 0
0.3188 -0.0191 0.1935 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8864 0.4594 -0.9532 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2744 0.6259 -1.0918 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1385 0.3104 -0.0638 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5675 -0.1744 1.0935 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2118 -0.3383 1.2323 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9571 0.9538 0.4173 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9523 2.0071 -0.3303 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8133 -1.9178 -1.6514 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4396 -3.1674 -0.4481 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8764 -1.8168 1.4204 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2632 0.7232 -1.8064 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6915 1.0105 -2.0166 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2147 0.4350 -0.1688 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2111 -0.4458 1.9248 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7348 -0.7243 2.1371 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7041 0.8593 1.2274 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3181 2.2762 -1.1473 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7189 2.7760 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 1 0
4 5 2 0
5 6 1 0
6 7 2 0
7 8 1 0
8 9 2 0
3 10 1 0
10 11 2 3
9 4 1 0
1 12 1 0
1 13 1 0
2 14 1 0
5 15 1 0
6 16 1 0
7 17 1 0
8 18 1 0
9 19 1 0
10 20 1 0
11 21 1 0
11 22 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers