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
-0.5984 3.1312 0.5395 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2044 1.9481 0.9937 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6468 0.7324 0.4382 N 0 0 0 0 0 0 0 0 0 0 0 0
0.3002 -0.2447 0.0837 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6558 -1.1882 1.0465 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5768 -2.1652 0.7522 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1591 -2.2246 -0.4956 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8092 -1.2961 -1.4432 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8899 -0.3121 -1.1658 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0273 0.5316 0.2536 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5210 -0.2080 -0.7155 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2433 4.0491 0.9843 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2847 3.2408 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4979 1.9511 1.8412 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1849 -1.1280 2.0327 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8580 -2.9029 1.4977 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8907 -2.9870 -0.7557 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2694 -1.3434 -2.4281 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5900 0.4347 -1.8844 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7230 1.0192 0.9571 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5789 -0.3463 -0.8359 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8541 -0.6917 -1.4113 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