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3,4-Diamino-n-(3-trifluoromethyl-phenyl)-benzenesulfonamide - 95%, high purity , CAS No.380349-00-8

COA

Grade & Purity:

≥95%

Cas Number: 380349-00-8
Molecular Weight: 331.3
PubChem CID: 3725287

In stock

Item Number

D184139

Grouped product items
SKU	Size	Availability	Price	Qty
D184139-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,560.90
D184139-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$3,462.90

Discover 3,4-Diamino-n-(3-trifluoromethyl-phenyl)-benzenesulfonamide by Aladdin Scientific in 95% for only $1,560.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	380349-00-8 \| 3,4-Diamino-N-(3-(trifluoromethyl)phenyl)benzenesulfonamide \| 3,4-Diamino-N-(3-trifluoromethyl-phenyl)-benzenesulfonamide \| 3,4-diamino-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide \| 3,4-Diamino-N-(3-(trifluoromethyl)-phenyl)benzenesulfonamide \| 3,
Specifications & Purity	≥95%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzenesulfonamides

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzenesulfonamides
Intermediate Tree Nodes	Not available
Direct Parent	Aminobenzenesulfonamides
Alternative Parents	Trifluoromethylbenzenes Sulfanilides Benzenesulfonyl compounds Aniline and substituted anilines Organosulfonamides Aminosulfonyl compounds Primary amines Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Aminobenzenesulfonamide - Sulfanilide - Trifluoromethylbenzene - Benzenesulfonyl group - Aniline or substituted anilines - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Primary amine - Organosulfur compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Amine - Organic nitrogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as aminobenzenesulfonamides. These are organic compounds containing a benzenesulfonamide moiety with an amine group attached to the benzene ring.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	3,4-diamino-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide
INCHI	InChI=1S/C13H12F3N3O2S/c14-13(15,16)8-2-1-3-9(6-8)19-22(20,21)10-4-5-11(17)12(18)7-10/h1-7,19H,17-18H2
InChIKey	GYPWNSMTTFOWFB-UHFFFAOYSA-N
Smiles	C1=CC(=CC(=C1)NS(=O)(=O)C2=CC(=C(C=C2)N)N)C(F)(F)F
Isomeric SMILES	C1=CC(=CC(=C1)NS(=O)(=O)C2=CC(=C(C=C2)N)N)C(F)(F)F
Molecular Weight	331.3
Reaxy-Rn	24045901
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=24045901&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	331.320 g/mol
XLogP3	2.000
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	3
Exact Mass	331.06 Da
Monoisotopic Mass	331.06 Da
Topological Polar Surface Area	107.000 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	478.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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