4-Bromo-2-{[(2,3-dimethyl-6-quinoxalinyl)imino]methyl}-6-methoxybenzenol - ≥90% , CAS No.672949-90-5

CAS: 672949-90-5 Cat. No.: B951617 Peso molecular: 386.25 PubChem CID: 4209971
Disponible para pedir
GRADE & PURITY ≥90%
Storage
Room temperature
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1mg
B951617-1mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
277,90US$
5mg
B951617-5mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
292,90US$
10mg
B951617-10mg
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321,90US$
500mg
B951617-500mg
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1.064,90US$
1g
B951617-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
1.914,90US$
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Why this grade

≥90% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Especificaciones y pureza
≥90%
Condiciones de almacenamiento de almacenamiento
Room temperature
Pureza
≥90%
Nombres e identificadores
Sonrisas canónicasCC1=C(N=C2C=C(C=CC2=N1)N=CC3=C(C(=CC(=C3)Br)OC)O)C
IUPAC Name4-bromo-2-[(2,3-dimethylquinoxalin-6-yl)iminomethyl]-6-methoxyphenol
InChIKeyNATZKSGVHZWXHN-UHFFFAOYSA-N
INCHI1S/C18H16BrN3O2/c1-10-11(2)22-16-8-14(4-5-15(16)21-10)20-9-12-6-13(19)7-17(24-3)18(12)23/h4-9,23H,1-3H3
Isómeros SMILES CC1=C(N=C2C=C(C=CC2=N1)N=CC3=C(C(=CC(=C3)Br)OC)O)C
PubChem CID 4209971
Peso molecular 386.25

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClaseDiazanaphthalenes
SubclassBenzodiazines
Intermediate Tree Nodes Not available
Direct ParentQuinoxalines
Alternative Parents Methoxyphenols  Phenoxy compounds  P-bromophenols  O-quinonimines  Methoxybenzenes  Anisoles  Bromobenzenes  Alkyl aryl ethers  Pyrazines  Secondary ketimines  Heteroaromatic compounds  Vinyl bromides  Propargyl-type 1,3-dipolar organic compounds  Bromoalkenes  Azacyclic compounds  Aldimines  Organopnictogen compounds  Organobromides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Quinoxaline - Methoxyphenol - Phenoxy compound - Methoxybenzene - Quinonimine - Phenol ether - 4-bromophenol - O-quinonimine - 4-halophenol - Anisole - Phenol - Halobenzene - Bromobenzene - Alkyl aryl ether - Benzenoid - Pyrazine - Monocyclic benzene moiety - Heteroaromatic compound - Secondary ketimine - Ketimine - Azacycle - Bromoalkene - Haloalkene - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Vinyl halide - Vinyl bromide - Ether - Aldimine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Imine - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as quinoxalines. These are compounds containing a quinoxaline moiety, a bicyclic heterocycle made up of a benzene ring fused to a pyrazine ring.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
Peso molecular386.200 g/mol
XLogP33.600
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass385.043 Da
Monoisotopic Mass385.043 Da
Topological Polar Surface Area67.600 Ų
Heavy Atom Count24
Formal Charge0
Complexity450.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculadoras de soluciones
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