3-Chloropyrazolo[1,5-a]pyrimidin-7-amine - CAS 1781902-80-4

Catalog:	BB051331
Product Name:	3-Chloropyrazolo[1,5-a]pyrimidin-7-amine
CAS:	1781902-80-4
Synonyms:	Pyrazolo[1,5-a]pyrimidin-7-amine, 3-chloro-

Technical Data

Computed Properties

IUPAC Name:	3-chloropyrazolo[1,5-a]pyrimidin-7-amine
Molecular Weight:	168.58
Molecular Formula:	C6H5ClN4
Canonical SMILES:	C1=C(N2C(=C(C=N2)Cl)N=C1)N
InChI:	InChI=1S/C6H5ClN4/c7-4-3-10-11-5(8)1-2-9-6(4)11/h1-3H,8H2
InChI Key:	XJVIXRLVYSUGDW-UHFFFAOYSA-N
Purity:	≥95%
Density:	1.71±0.1 g/cm3 (Predicted)

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Related Functional Groups

Amines and Anilines

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1-Cyclopentyl-1H-pyrazole-3,5-diamine
[1431965-90-0]
1-Cyclopentyl-5-methylpyrazol-3-amine hydrochloride
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2,2-Dimethyl-1-pyrazol-1-ylmethyl-propylamine hydrochloride
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2-Amino-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Halides

[1225940-17-9]
1-(3-Chloro-4-methylphenyl)-3-(trifluoromethyl)pyrazole-5-ylamine
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[1820736-42-2]
1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
[35989-28-7]
2,5-Dichloro-4-fluorobenzoic acid
[4185-62-0]
2-Bromo-1-nitronaphthalene
[393841-81-1]
2'-Bromo-2,7-DI-tert-butyl-9,9'-spirobi[fluorene]

Pyrazolo[n,m-d]Pyrimidine

[335223-43-3]
Ethyl 2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetate
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Ethyl 2-(4-oxo-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-5(4H)-yl)acetate
[938001-08-2]
Ethyl 7-(difluoromethyl)-5-oxo-4,5-dihydropyrazolo[1,5-a]pyrimidine-2-carboxylate
[1215067-79-0]
7-amino-3H-pyrazolo[4,3-d]pyrimidine-3-carboxylic acid
[1855889-10-9]
Methyl [(5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-yl)oxy]acetate
[1781902-80-4]
3-Chloropyrazolo[1,5-a]pyrimidin-7-amine

Complexity:	154
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	168.0202739
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	168.0202739
Rotatable Bond Count:	0
Topological Polar Surface Area:	56.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.6