5-(methoxycarbonyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid

5-(methoxycarbonyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid

CAS: 916212-00-5

Formula: C9H7N3O4

SMILES: COC(=O)C1=NC2=CC=NN2C(=C1)C(O)=O

IUPAC: 5-(methoxycarbonyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid

InChI: InChI=1S/C9H7N3O4/c1-16-9(15)5-4-6(8(13)14)12-7(11-5)2-3-10-12/h2-4H,1H3,(H,13,14)

Composition: C (48.88%), H (3.19%), N (19.00%), O (28.93%)

Molar Mass: 221.172

Atom Count: 23

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	221.043655717
Formal Charge	0
FSP3	0.11
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	MOIIRWONWNLXQH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.56
Topological Polar Surface Area	93.79
Polarizability	19.36
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
92%	<5 Days	916212-00-5		$290.03-$448.92$290.03$448.92