AG00II7U

944896-64-4 | Imidazo[1,2-a]pyrimidine-6-carboxylic acid

AG00II7U

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CAS Number	944896-64-4
Catalog Number	AG00II7U(AGN-PC-0WAMQA)
Chemical Name	Imidazo[1,2-a]pyrimidine-6-carboxylic acid
IUPAC Name	imidazo[1,2-a]pyrimidine-6-carboxylic acid
InChI	InChI=1S/C7H5N3O2/c11-6(12)5-3-9-7-8-1-2-10(7)4-5/h1-4H,(H,11,12)
InChI Key	IRCKAWIBTUJQID-UHFFFAOYSA-N
MDL Number	MFCD10698088
Molecular Formula	C7H5N3O2
Molecular Weight	163.1335
SMILES	C(=O)(O)c1cn2c(nc1)ncc2
Synonyms	IMIDAZO[1,2-A]PYRIMIDINE-6-CARBOXYLIC ACID, 944896-64-4, SCHEMBL156974, IRCKAWIBTUJQID-UHFFFAOYSA-N, KS-00000OF3, MFCD10698088, ZINC82404718, AKOS006302737, AB61246, ACN-040556, AK-41829, DS-13990, SY119067, AJ-125298, CS-0035932, FT-0749627, MFCD10698088 (95%), Z2739025477, -pyrrolo[1,2-a]pyrimidine-3-carboxylic acid,

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	0.6

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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