AG0039PC

876-03-9 | 3-(Aminomethyl)benzoic acid hydrochloride

AG0039PC

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CAS Number	876-03-9
Catalog Number	AG0039PC(AGN-PC-0VF7CF)
Chemical Name	3-(Aminomethyl)benzoic acid hydrochloride
IUPAC Name	3-(aminomethyl)benzoic acid;hydrochloride
InChI	InChI=1S/C8H9NO2.ClH/c9-5-6-2-1-3-7(4-6)8(10)11;/h1-4H,5,9H2,(H,10,11);1H
InChI Key	SJCCOASSOPUHEN-UHFFFAOYSA-N
MDL Number	MFCD03791117
Molecular Formula	C8H10ClNO2
Molecular Weight	187.6235
SMILES	Cl.NCC1=CC=CC(=C1)C(=O)O
Synonyms	3-(Aminomethyl)benzoic acid hydrochloride, 876-03-9, 3-Aminomethylbenzoic acid hydrochloride, 3-Aminomethylbenzoic acid HCl, 3-(aminomethyl)-benzoic acid hydrochloride, MFCD03791117, CHEMBL541141, ACMC-209tzp, AC1Q3D6G, SCHEMBL4232340, CTK7E5333, KS-00000MJY, 3-(Aminomethyl)Benzoic Acid HCl, DTXSID70585031, 3-Carboxybenzylamine hydrochloride, SJCCOASSOPUHEN-UHFFFAOYSA-N, 3-(Aminomethyl)benzoic acid, HCl, 3-aminomethyl-benzoic acid HCl salt, ANW-43139, RW2987, SBB052654, 3-(aminomethyl)benzoic acid, chloride, AKOS004118474, CS-W001871, MCULE-3333725886, PS-8451, QC-2744, RP24753, VZ26060, 3-(Aminomethyl)benzoicacid hydrochloride, AK-36663, AN-47889, BR-36663, SC-28534, SY018502, U110, (3-Aminomethyl) benzoic acid hydrochloride, AB0019102, DB-028355, ST2417382, TR-027540, AM20060744, FT-0084657, FT-0633054, EN300-70607, MFCD03791117 (95%), A29361, S-3524, 876A039, J-511694, 3-(Aminomethyl)benzoic acid--hydrogen chloride (1/1), Z1262691668, 3-(Aminomethyl)benzoic acid hydrochloride, >=98.0% (HPLC), C8H10ClNO2, 3-Aminomethylbenzoicacidhydrochloride, 2393-20-6,

Complexity	147
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	187.04g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	187.623g/mol
Monoisotopic Mass	187.04g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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