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
2.8113 -1.7573 0.0891 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7085 -0.5246 0.5102 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4459 0.5826 -0.3405 N 0 0 0 0 0 0 0 0 0 0 0 0
1.1850 0.4250 -1.4986 S 0 0 0 0 0 6 0 0 0 0 0 0
1.4863 -0.6850 -2.4699 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1581 1.7019 -2.3270 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3666 0.1538 -0.7383 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1969 1.1968 -0.3796 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4332 0.9594 0.2269 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8549 -0.3142 0.4822 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0446 -1.3601 0.1333 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8152 -1.1228 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1826 -0.4950 1.1307 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2334 1.7741 -0.2016 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6971 -1.9857 -0.9496 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0104 -2.5448 0.7829 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8272 -0.3065 1.5717 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9140 2.2133 -0.5574 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0699 1.8037 0.5002 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3733 -2.3633 0.3327 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1796 -1.9543 -0.7432 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2743 0.1161 2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9827 -0.2540 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3252 -1.5515 1.4246 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3191 1.6072 -0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9053 2.5828 -0.8645 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2255 2.1025 0.8758 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