CAS 19798-81-3 2-Amino-6-bromopyridine (HCID 300809)

Names & identifiers

Preferred name: 2-Amino-6-bromopyridine
IUPAC: 6-bromopyridin-2-amine
English name: 2-Amino-6-bromopyridine
Molecular formula: C5H5BrN2
Molecular weight: 173.01

Names & synonyms

2-Amino-6-bromopyridine19798-81-36-bromopyridin-2-amineDTXSID00306418RefChem:464724DTXCID90257546606-385-72-Pyridinamine, 6-bromo-6-Bromo-2-pyridinamineMFCD001378436-BROMO-PYRIDIN-2-YLAMINE1184170-10-2

Show more names

2-AMINO-6-BROMO-PHENOLAminobromopyridine2-AMINO-6-BROMPYRIDINE2A6BP2-Bromo-6-Aminopyridine

6-bromopyridine-2-amine2-Bromo-6-aminopyridine; 6-Bromo-2-aminopyridine; 6-Bromo-2-pyridinamine; 6-Bromopyridin-2-ylamine; NSC 176170;NSC1761706-bromo-2-pyridylamine6-bromopyrid-2-ylamine6-amino-2-bromopyridine6-bromo-2-aminopyridine6-bromopyridin-2-ylamine

Database identifiers

CAS: 19798-81-3
PubChem CID: 300809
DTXSID: DTXSID00306418
ChEMBL: CHEMBL2426226
UNII: XH2AZ5E9WD
EC Number: 606-385-7
Nikkaji: J82.897A

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 38.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 0
Heavy atoms: 8
Formal charge: 0
Complexity: 76.8

Physicochemical properties

Melting point: 88 · 88-91 °C (lit.)
Boiling point: 273 · 273.0±20.0 °C(Predicted)
Density: 1.71 · 1.710±0.06 g/cm3(Predicted)
storage temp.: Keep in dark place,Sealed in dry,Room Temperature
solubility: Chloroform (Slightly), Methanol (Very Slightly)
pka: 2.73 · 2.73±0.24(Predicted)
form: Powder
color: Slightly yellow to light brown
Water Solubility: Slightly soluble in water.
InChI: InChI=1S/C5H5BrN2/c6-4-2-1-3-5(7)8-4/h1-3H,(H2,7,8)
InChIKey: BKLJUYPLUWUEOQ-UHFFFAOYSA-N
SMILES: C1(N)=NC(Br)=CC=C1
CAS DataBase Reference: 19798 · 19798-81-3(CAS DataBase Reference)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs: Respiratory system
PPE: 95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes: Xi,Xn
Risk Statements: 36 · 36/37/38-20/21/22
Safety Statements: 26 · 26-36-36/37/39
WGK Germany: 3 · 3
HazardClass: IRRITANT
HS Code: 29333999 · 29333999
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
REACH Registrations: Active

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (16.4%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 55 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory InformationStatus: Active Update: 20-07-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/30711

Hazard Classes and CategoriesAcute Tox. 4 (16.4%)

Safety data

PPE: dust mask type N95 (US), Eyeshields, Gloves
wgk: 3
hs_code: 29333999
risk_code: 36/37/38-20/21/22
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi,Xn
safety_code: 26-36-36/37/39
hazard_class: IRRITANT
Storage Class: 11 - Combustible Solids
target organs: Respiratory system
Hazard statements: H315-H319-H335
REACH Registrations: Active
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements: P261-P264-P271-P280-P302+P352-P305+P351+P338

Chemistry & industry

Applications · 3 items

UsesEmployed in an efficient one-pot synthesis of 7-azaindoles. Used in the synthesis of anti-HIV agents.

Uses2-Amino-6-bromopyridine is a disubstituted pyridine used as a building block in the preparation of nitrogen containing bicyclic and polycylic compounds.

General Description2-Amino- 6-bromopyridine has been synthesized from epichlorohydrin.

Upstream & downstream products

Upstream raw materials

Downstream products

Filgotinib 5-Bromoimidazo[1,2-a]pyridine-2-carboxylic acid cyclopropanecarboxylic acid (5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-amide 2-Bromo-6-nitropyridine 6-(Di-Boc-amino)-2-bromopyridine (6-Bromo-2-pyridinyl)-carbamic acid,1,1-dimethylethyl ester 2-Amino-6-methoxypyridine 5-Bromo-imidazo[1,2-a]pyridine HBr 6-(1H-IMidazol-1-yl)pyridin-2-aMine 6-(Pyrrolidin-1-yl)pyridin-2-amine N2-Methylpyridine-2,6-diaMine

Suppliers100 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]

阜新奥瑞凯精细化工有限公司0418-5113999 18740177324 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

INTATRADE GmbH+49 3493/605464 · [email protected]

Related reactions

178 records

New reaction record

HRID 17951As reactantuspto-grants-2010_06

HRID 32800As reactantuspto-grants-2008_09

HRID 75925As reactantuspto-grants-2014_09

HRID 77728As reactantuspto-grants-2014_09

HRID 88706As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 91456As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 105429As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 106870As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

Compound notes

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Basic information