4-{3-bromopyrazolo[1,5-a]pyrimidin-6-yl}phenol

4-{3-bromopyrazolo[1,5-a]pyrimidin-6-yl}phenol

CAS: 945376-95-4

Formula: C12H8BrN3O

SMILES: OC1=CC=C(C=C1)C1=CN2N=CC(Br)=C2N=C1

IUPAC: 4-{3-bromopyrazolo[1,5-a]pyrimidin-6-yl}phenol

InChI: InChI=1S/C12H8BrN3O/c13-11-6-15-16-7-9(5-14-12(11)16)8-1-3-10(17)4-2-8/h1-7,17H

Composition: C (49.68%), H (2.78%), Br (27.54%), N (14.48%), O (5.51%)

Molar Mass: 290.12

Atom Count: 25

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	288.985075
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	XBHIAJWNXVJSAA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	78.51
Topological Polar Surface Area	50.42
Polarizability	26.68
Ring Count	3
Rotatable Bond Count	1

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98%	<7 Days	945376-95-4		$314.64$314.64