BNN3 - ≥98% , CAS No.6947-38-2

CAS: 6947-38-2 Cat. No.: B332333 Molecular Weight: 194.19

GRADE & PURITY ≥98%

Synonyms

SCHEMBL3123070 | NSC56933 | NSC-56933 | N-methyl-N-[4-[methyl(nitroso)amino]phenyl]nitrous amide | HY-153056 | AKOS006278036 | EX-A6938 | MS-23049 | N,N'-1,4-Phenylenebis(N-methylnitrous amide) | DTXSID30989399 | FT-0667419 | N,N'-DIMETHYL-N,N'-DINITROSO-

Storage

Protected from light,Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Overview

BNN3 is a cell-permeable, caged, photolabile nitric oxide (NO) donor (λ|Em (max)|: ~300nm) which produces two NO molecules per molecule of BNN3 upon irradiation (300-360nm) with a xenon lamp or laser flashlight. BNN3 causes photo-induced vasorelaxation in rat aortic strips and is useful for delivering nitric oxide into intracellular compartments on a microsecond time scale without any cytotoxic effects. BNN3 is stable at a variety of pH levels and its release of NO is not affected by the presence of thiols in biological systems.

Specifications

Synonyms

SCHEMBL3123070 | NSC56933 | NSC-56933 | N-methyl-N-[4-[methyl(nitroso)amino]phenyl]nitrous amide | HY-153056 | AKOS006278036 | EX-A6938 | MS-23049 | N, N'-1, 4-Phenylenebis(N-methylnitrous amide) | DTXSID30989399 | FT-0667419 | N, N'-DIMETHYL-N, N'-DINITROSO-

Specifications & Purity

≥98%

Storage

Protected from light, Store at -20°C, Argon charged

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Action Type

ACTIVATOR

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488188971
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488188971
• Canonical Smiles: CN(C1=CC=C(C=C1)N(C)N=O)N=O
• IUPAC Name: N-methyl-N-[4-[methyl(nitroso)amino]phenyl]nitrous amide
• InChIKey: WKDYJAMEXVFEEA-UHFFFAOYSA-N
• INCHI: 1S/C8H10N4O2/c1-11(9-13)7-3-5-8(6-4-7)12(2)10-14/h3-6H,1-2H3
• Isomeric SMILES: CN(C1=CC=C(C=C1)N(C)N=O)N=O
• Molecular Weight: 194.19
• Reaxy-Rn: 3531543
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3531543&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Phenylhydrazines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Phenylhydrazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylhydrazines
• Alternative Parents: Organic N-nitroso compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylhydrazine - Organic n-nitroso compound - Organic nitroso compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as phenylhydrazines. These are compounds containing a phenylhydrazide moiety, which consists of a hydrazide substituent attached to a phenyl group.
• External Descriptors: Not available

Data sources

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

Chemical and Physical Properties

• Solubility: Soluble in DMSO (1mg/ml).
• Sensitivity: light sensitive
• Molecular Weight: 194.190 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 194.08 Da
• Monoisotopic Mass: 194.08 Da
• Topological Polar Surface Area: 65.300 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 182.000
• 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