AG0017B4

1224944-51-7 | Pyrazolo[1,5-a]pyrimidine-3-carboxylic acid, 5-chloro-, methyl ester

AG0017B4

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CAS Number	1224944-51-7
Catalog Number	AG0017B4(AGN-PC-0C7BJH)
Chemical Name	Pyrazolo[1,5-a]pyrimidine-3-carboxylic acid, 5-chloro-, methyl ester
IUPAC Name	methyl 5-chloropyrazolo[1,5-a]pyrimidine-3-carboxylate
InChI	InChI=1S/C8H6ClN3O2/c1-14-8(13)5-4-10-12-3-2-6(9)11-7(5)12/h2-4H,1H3
InChI Key	FDJUGKZMZUVEJD-UHFFFAOYSA-N
MDL Number	MFCD22551533
Molecular Formula	C8H6ClN3O2
Molecular Weight	211.6051
SMILES	O=C(C1=C2N=C(Cl)C=CN2N=C1)OC
Synonyms	Methyl 5-chloropyrazolo[1,5-a]pyrimidine-3-carboxylate, 1224944-51-7, AK134796, SCHEMBL10190991, DTXSID50728727, FDJUGKZMZUVEJD-UHFFFAOYSA-N, KS-00000RL6, 4271AA, MFCD22551533, ZINC95093484, AKOS016842606, CS-W006914, DS-4834, FCH2280671, AJ-132574, AX8256563, ST2413451, 4CH-016700, Pyrazolo[1,5-a]pyrimidine-3-carboxylic acid, 5-chloro-, methyl ester, C8H6ClN3O2, Methyl5-chloropyrazolo[1,5-a]pyrimidine-3-carboxylate, 60166-44-1,

Complexity	239
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	211.015g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	211.605g/mol
Monoisotopic Mass	211.015g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	56.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

Lot Number