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5-Chloropyrazolo[1,5-a]pyrimidine-3-carbaldehyde

5-Chloropyrazolo[1,5-a]pyrimidine-3-carbaldehyde - CAS 1256162-94-3

Catalog:	BB006147
Product Name:	5-Chloropyrazolo[1,5-a]pyrimidine-3-carbaldehyde
CAS:	1256162-94-3
Synonyms:	5-chloro-3-pyrazolo[1,5-a]pyrimidinecarboxaldehyde; 5-chloropyrazolo[1,5-a]pyrimidine-3-carbaldehyde

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	5-chloropyrazolo[1,5-a]pyrimidine-3-carbaldehyde
Description:	5-Chloropyrazolo[1,5-a]pyrimidine-3-carbaldehyde (CAS# 1256162-94-3) is a useful research chemical.
Molecular Weight:	181.58
Molecular Formula:	C7H4ClN3O
Canonical SMILES:	C1=CN2C(=C(C=N2)C=O)N=C1Cl
InChI:	InChI=1S/C7H4ClN3O/c8-6-1-2-11-7(10-6)5(4-12)3-9-11/h1-4H
InChI Key:	NYWPUMGVBDABLA-UHFFFAOYSA-N
LogP:	1.19520

Publication Number	Title	Priority Date
CN-112979654-A	Heteroaryl fused ring compound, preparation method and application thereof	20191216
WO-2017007759-A1	Diaryl macrocycle polymorph	20150706
CA-2971024-A1	Fused ring heteroaryl compounds and their use as trk inhibitors	20141215
CN-107207514-A	Fused ring heteroaryl compound and its purposes as TRK inhibitor	20141215
CN-107207514-B	Fused heteroaryl compounds and their use as TRK inhibitors	20141215

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Related Functional Groups

Carbonyl Compounds

[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[2168559-63-3]
2-(6-Methyl-2-pyridyl)acetic Acid Hydrochloride
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[927676-51-5]
2-(6-Bromo-3-indolyl)-2-oxoacetic Acid

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	190
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	181.0042895
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	181.0042895
Rotatable Bond Count:	1
Topological Polar Surface Area:	47.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.7