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26831-90-3 manufacturers and suppliers on PharmaCompass

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26831-90-3
Also known as: 26831-90-3, N-(2-hydroxyethyl)-n-(2-hydroxypropyl)-4-methylbenzenesulfonamide, Einecs 248-021-6, Nsc163919, Dtxsid201166994, N-(2-hydroxyethyl)-n-(2-hydroxypropyl)-p-toluenesulfonamide
Molecular Formula
C12H19NO4S
Molecular Weight
273.35  g/mol
InChI Key
WWOVSKZHPUOOJS-UHFFFAOYSA-N

1 2D Structure

26831-90-3

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-4-methylbenzenesulfonamide
2.1.2 InChI
InChI=1S/C12H19NO4S/c1-10-3-5-12(6-4-10)18(16,17)13(7-8-14)9-11(2)15/h3-6,11,14-15H,7-9H2,1-2H3
2.1.3 InChI Key
WWOVSKZHPUOOJS-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=CC=C(C=C1)S(=O)(=O)N(CCO)CC(C)O
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 26831-90-3

2. N-(2-hydroxyethyl)-n-(2-hydroxypropyl)-4-methylbenzenesulfonamide

3. Einecs 248-021-6

4. Nsc163919

5. Dtxsid201166994

6. N-(2-hydroxyethyl)-n-(2-hydroxypropyl)-p-toluenesulfonamide

7. Akos024332400

8. Nsc 163919

9. Nsc-163919

10. Benzenesulfonamide, N-(2-hydroxyethyl)-n-(2-hydroxypropyl)-4-methyl-

2.3 Create Date
2005-03-25
3 Chemical and Physical Properties
Molecular Weight 273.35 g/mol
Molecular Formula C12H19NO4S
XLogP30.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area86.2
Heavy Atom Count18
Formal Charge0
Complexity331
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
Flag India
Digital Content Digital Content
URL Supplier Web Content
26831-90-3
Levocabastine
The Bakul Group of companies headquartered in Mumbai, India are engaged in the development and manufactur...
The Bakul Group of companies headquartered in Mumbai, India are engaged in the development and manufacture of high-quality Active Pharmaceutical Ingredients (APIs), Intermediates, and Speciality Chemicals. Since our inception in 1975, we have grown to become world leaders in the area of xanthine chemistry. They specialize in manufacturing APIs such as Linagliptin, Pentoxifylline, Theobromine, Doxofylline, Caffeine, Pamabrom, and others.
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