6-(aminomethyl)-1,2-benzoxazol-3-amine hydrochloride

6-(aminomethyl)-1,2-benzoxazol-3-amine hydrochloride

CAS: 510772-92-6

Formula: C8H10ClN3O

SMILES: Cl.NCC1=CC=C2C(N)=NOC2=C1

IUPAC: 6-(aminomethyl)-1,2-benzoxazol-3-amine hydrochloride

InChI: InChI=1S/C8H9N3O.ClH/c9-4-5-1-2-6-7(3-5)12-11-8(6)10;/h1-3H,4,9H2,(H2,10,11);1H

Composition: C (48.13%), H (5.05%), Cl (17.76%), N (21.05%), O (8.01%)

Molar Mass: 199.64

Atom Count: 23

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	199.0512397
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	WYJXUJQXMYOKGM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.32
Topological Polar Surface Area	78.07
Polarizability	18.33
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	510772-92-6		$2,640.00-$6,451.00$2,640.00$4,224.00$6,451.00