Monomers
N,4-dimethyl-N-vinylbenzenesulfonamide
Identifiers
IUPAC name
N-ethenyl-N,4-dimethylbenzenesulfonamide
InchI
InChI=1S/C10H13NO2S/c1-4-11(3)14(12,13)10-7-5-9(2)6-8-10/h4-8H,1H2,2-3H3
InchI Key
KNFILXSWEXSJCV-UHFFFAOYSA-N
SMILES
C=CN(S(=O)(=O)c1ccc(cc1)C)C
Canonical SMILES
CC1=CC=C(C=C1)S(=O)(=O)N(C)C=C
Isomeric SMILES
CC1=CC=C(C=C1)S(=O)(=O)N(C)C=C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C10H13NO2S
Heavy Atom Count
14
Molecular Weight
211.286
Exact Molecular Weight
211.0667
Valence Electrons
76
Radical Electrons
0
tPSA
37.38
MolLogP
1.759
H Bond Acceptors
2
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
-1.5846 2.0743 0.7351 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5104 1.4546 0.0053 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6162 0.0409 0.1356 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.6322 -0.9335 -0.8680 S 0 0 0 0 0 6 0 0 0 0 0 0
-1.9849 -2.3899 -0.7656 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9213 -0.5287 -2.3048 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0688 -0.6754 -0.6015 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8078 -1.3913 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1488 -1.1799 0.5203 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8222 -0.2198 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0935 0.5024 -1.1295 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7449 0.2902 -1.3334 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2745 -0.0040 0.0245 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5482 -0.4744 1.1071 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4482 3.1467 0.6865 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9264 1.5388 1.4092 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1247 2.0371 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3048 -2.1447 0.8966 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7328 -1.7530 1.2541 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6275 1.2518 -1.6948 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1801 0.8676 -2.0655 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6826 0.6931 -0.7286 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8346 -0.9606 0.0848 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4224 0.5029 1.0142 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5926 -0.1380 0.9108 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2779 -0.0320 2.0975 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5777 -1.5752 1.1362 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
4 6 2 0
4 7 1 0
7 8 2 0
8 9 1 0
9 10 2 0
10 11 1 0
11 12 2 0
10 13 1 0
3 14 1 0
12 7 1 0
1 15 1 0
1 16 1 0
2 17 1 0
8 18 1 0
9 19 1 0
11 20 1 0
12 21 1 0
13 22 1 0
13 23 1 0
13 24 1 0
14 25 1 0
14 26 1 0
14 27 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers