AG00073Y

1022920-59-7 | Pyrazolo[1,5-a]pyrimidine-6-carboxylic acid, ethyl ester

AG00073Y

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CAS Number	1022920-59-7
Catalog Number	AG00073Y(AGN-PC-0BS6P2)
Chemical Name	Pyrazolo[1,5-a]pyrimidine-6-carboxylic acid, ethyl ester
IUPAC Name	ethyl pyrazolo[1,5-a]pyrimidine-6-carboxylate
InChI	InChI=1S/C9H9N3O2/c1-2-14-9(13)7-5-10-8-3-4-11-12(8)6-7/h3-6H,2H2,1H3
InChI Key	BMYWIFFHYYKNFM-UHFFFAOYSA-N
MDL Number	MFCD19443836
Molecular Formula	C9H9N3O2
Molecular Weight	191.1867
SMILES	O=C(C1=CN2C(N=C1)=CC=N2)OCC
Synonyms	Ethyl pyrazolo[1,5-a]pyrimidine-6-carboxylate, 1022920-59-7, SCHEMBL3611630, CTK8B5244, DTXSID80721009, BMYWIFFHYYKNFM-UHFFFAOYSA-N, ANW-48106, MFCD19443836, SC4418, ZINC72482155, AKOS015919818, FCH1133901, PB15412, KS-000007A9, AK-77959, AS-54672, BR-77959, 6-ethoxycarbonylpyrazolo[1,5-a]pyrimidine, AB0034447, AJ-121222, AX8224472, TC-136851, CS-0049391, ST24025072, X8602, S-6807, pyrazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester, PYRAZOLO[1,5-A]PYRIMIDINE-6-CARBOXYLIC ACID, ETHYL ESTER, C9H9N3O2, Ethylpyrazolo[1,5-a]pyrimidine-6-carboxylate,

Complexity	222
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	191.069g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	191.19g/mol
Monoisotopic Mass	191.069g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	56.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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