2-Amino-5-bromo-4-(trifluoromethyl)pyridine - CAS 944401-56-3

Name: 2-Amino-5-bromo-4-(trifluoromethyl)pyridine
Brand: BOC Sciences
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Catalog:	BB041317
Product Name:	2-Amino-5-bromo-4-(trifluoromethyl)pyridine
CAS:	944401-56-3
Synonyms:	5-bromo-4-(trifluoromethyl)pyridin-2-amine

Technical Data

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Patents

Computed Properties

IUPAC Name:	5-bromo-4-(trifluoromethyl)pyridin-2-amine
Description:	2-Amino-5-bromo-4-(trifluoromethyl)pyridine (CAS# 944401-56-3) is a useful research chemical.
Molecular Weight:	241.01
Molecular Formula:	C6H4BrF3N2
Canonical SMILES:	C1=C(C(=CN=C1N)Br)C(F)(F)F
InChI:	InChI=1S/C6H4BrF3N2/c7-4-2-12-5(11)1-3(4)6(8,9)10/h1-2H,(H2,11,12)
InChI Key:	AEWYLVDLWQPJGW-UHFFFAOYSA-N
Boiling Point:	243.9 °C at 760 mmHg
Density:	1.79 g/cm³
LogP:	3.02630

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Related Functional Groups

Fluorinated Building Blocks

[1946823-77-3]C7H9F3N2O
[1,4-Dimethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[452-76-6]C7H6F2
2,4-Difluorotoluene
[459836-92-1]C8H6F2O2
3,6-Difluoro-2-methylbenzoic acid
[1795420-51-7]C6H6F3N3O2
3-Amino-1-(2,2,2-trifluoroethyl)pyrazole-4-carboxylic acid
[351-28-0]C8H8FNO
3'-Fluoroacetanilide

Other Pyrimidines

[452-76-6]C7H6F2
2,4-Difluorotoluene
[351-28-0]C8H8FNO
3'-Fluoroacetanilide
[13566-71-7]C10H8N2O2
4(3H)-Pyrimidinone,6-hydroxy-2-phenyl-
[451-46-7]C9H9FO2
Ethyl 4-fluorobenzoate
[207605-39-8]C8H2F5NO2
trans-2,3,4,5,6-Pentafluoro-β-nitrostyrene
[77776-68-2]C6HCl3N4
2,4,8-Trichloropyrimido[5,4-d]pyrimidine

Pyridines

[1951441-75-0]C8H13ClN2O
2-(6-Methoxypyridin-2-yl)ethan-1-amine hydrochloride
[104496-91-5]C7H9N3OS
2-(Pyridin-2-ylthio)acetohydrazide
[149463-07-0]C6H6Cl2FN
2-(Chloromethyl)-3-fluoropyridine Hydrochloride
[267242-99-9]C9H10ClN
2-Chloro-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine
[1198098-45-1]C11H12N2
3-Allyl-5-methyl-1H-pyrrolo[2,3-b]pyridine
[1087659-19-5]C14H12N2O4
3-Methoxy-5-(phenylcarbamoyl)isonicotinic acid

GHS Hazard Statement:	H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2021122745-A1	4-[[(7-aminopyrazolo[1,5-a]pyrimidin-5-yl)amino]methyl]piperidin-3-ol compounds and their therapeutic use	20191216
WO-2021055747-A1	Therapeutic conjugates	20190919
WO-2020263186-A1	Compounds for treatment of cancer	20190625
US-2020339559-A1	Heterocyclic compounds and their use for treatment of helminthic infections and diseases	20190426
WO-2020219871-A1	Heterocyclic compounds and their use for treatment of helminthic infections and diseases	20190426

Complexity:	161
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	239.95100
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	239.95100
Rotatable Bond Count:	0
Topological Polar Surface Area:	38.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1