ethyl 4-amino-5-bromo-1H-pyrazole-3-carboxylate

ethyl 4-amino-5-bromo-1H-pyrazole-3-carboxylate

Formula: C6H8BrN3O2

SMILES: CCOC(=O)C1=NNC(Br)=C1N

IUPAC: ethyl 4-amino-5-bromo-1H-pyrazole-3-carboxylate

InChI: InChI=1S/C6H8BrN3O2/c1-2-12-6(11)4-3(8)5(7)10-9-4/h2,8H2,1H3,(H,9,10)

Composition: C (30.79%), H (3.45%), Br (34.14%), N (17.95%), O (13.67%)

Molar Mass: 234.053

Atom Count: 20

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	232.97999
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	ILCPMHDLWQWUDN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.25
Topological Polar Surface Area	81
Polarizability	17.72
Ring Count	1
Rotatable Bond Count	3

Suppliers

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
95%	<5 Days	C6H8BrN3O2		$2,400.00$2,400.00