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3-bromo-1,5,6,7-tetrahydro-1,8-naphthyridine - 97%, high purity , CAS No.1023813-80-0

COA

Grade & Purity:

≥97%

Cas Number: 1023813-80-0
Molecular Weight: 213.07
EC Number: 816-262-1
MDL number: MFCD09881254
PubChem CID: 17930126

In stock

Item Number

B626562

Grouped product items
SKU	Size	Availability	Price
B626562-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$387.90
B626562-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,615.90
B626562-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$3,229.90

Basic Description

Synonyms	SCHEMBL1258438 \| 6-Bromo-1,2,3,4-tetrahydro-[1,8]naphthyridine \| 5,6,7,8-TETRAHYDRO-[1,8]NAPHTHYRIDINE-3-BROMIDE \| Z1269123899 \| F1957-0202 \| OVYOPQIKOHSBSV-UHFFFAOYSA-N \| YQB81380 \| SY009008 \| DTXSID80591623 \| EN300-265444 \| AKOS000276570 \| 1023813-80-0
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Diazanaphthalenes
    - Subclass Naphthyridines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Diazanaphthalenes
Subclass	Naphthyridines
Intermediate Tree Nodes	Not available
Direct Parent	Naphthyridines
Alternative Parents	Pyridines and derivatives Imidolactams Aryl bromides Heteroaromatic compounds Azacyclic compounds Organobromides Hydrocarbon derivatives Amines
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Naphthyridine - Imidolactam - Pyridine - Aryl halide - Aryl bromide - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Amine - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as naphthyridines. These are compounds containing a naphthyridine moiety, a naphthalene in which a carbon atom has been replaced by a nitrogen in each of the two rings. The naphthyridine skeleton can also be described as an assembly two fused pyridine rings, which do not share their nitrogen atom.
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	6-bromo-1,2,3,4-tetrahydro-1,8-naphthyridine
INCHI	InChI=1S/C8H9BrN2/c9-7-4-6-2-1-3-10-8(6)11-5-7/h4-5H,1-3H2,(H,10,11)
InChIKey	OVYOPQIKOHSBSV-UHFFFAOYSA-N
Smiles	C1CC2=C(NC1)N=CC(=C2)Br
Isomeric SMILES	C1CC2=C(NC1)N=CC(=C2)Br
Alternate CAS	1023813-80-0
PubChem CID	17930126
Molecular Weight	213.07

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	213.070 g/mol
XLogP3	2.300
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	211.995 Da
Monoisotopic Mass	211.995 Da
Topological Polar Surface Area	24.900 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	140.000
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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