AG00DL8Y

53902-76-4 | Pyrazolo[1,5-a]pyrazine-3-carboxylic acid

AG00DL8Y

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CAS Number	53902-76-4
Catalog Number	AG00DL8Y(AGN-PC-0WNNYA)
Chemical Name	Pyrazolo[1,5-a]pyrazine-3-carboxylic acid
IUPAC Name	pyrazolo[1,5-a]pyrazine-3-carboxylic acid
InChI	InChI=1S/C7H5N3O2/c11-7(12)5-3-9-10-2-1-8-4-6(5)10/h1-4H,(H,11,12)
InChI Key	KDZOHLVVUNZUQC-UHFFFAOYSA-N
MDL Number	MFCD11865260
Molecular Formula	C7H5N3O2
Molecular Weight	163.1335
SMILES	N1=CC(=C2N1C=CN=C2)C(=O)O
Synonyms	PYRAZOLO[1,5-A]PYRAZINE-3-CARBOXYLIC ACID, 53902-76-4, SCHEMBL1693714, DTXSID90736482, KDZOHLVVUNZUQC-UHFFFAOYSA-N, MFCD11865260, ZINC40435255, AKOS023410264, MCULE-4162934389, AS-42421, X-3948, F2199-0134, Z1821397707,

Complexity	197
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	163.038g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	163.136g/mol
Monoisotopic Mass	163.038g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	67.5A^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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