4-(aminomethyl)-2-chlorobenzoic acid hydrochloride

4-(aminomethyl)-2-chlorobenzoic acid hydrochloride

CAS: 1208507-67-8

Formula: C8H9Cl2NO2

SMILES: Cl[H].NCC1=CC=C(C(O)=O)C(Cl)=C1

IUPAC: 4-(aminomethyl)-2-chlorobenzoic acid hydrochloride

InChI: InChI=1S/C8H8ClNO2.ClH/c9-7-3-5(4-10)1-2-6(7)8(11)12;/h1-3H,4,10H2,(H,11,12);1H

Composition: C (43.27%), H (4.09%), Cl (31.93%), N (6.31%), O (14.41%)

Molar Mass: 222.07

Atom Count: 22

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	221.0010339
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	HKGZXZAPRNYUMN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.59
Topological Polar Surface Area	63.32
Polarizability	17.94
Ring Count	1
Rotatable Bond Count	2

Suppliers

Acrotein ChemBio Inc.,

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97%	<7 Days	1208507-67-8		$181.44-$413.76$181.44$275.52$413.76