AG00FGH1

658683-12-6 | 2-(1-Aminoethyl)benzoic acid hydrochloride

AG00FGH1

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CAS Number	658683-12-6
Catalog Number	AG00FGH1(AGN-PC-09RR17)
Chemical Name	2-(1-Aminoethyl)benzoic acid hydrochloride
IUPAC Name	2-(1-aminoethyl)benzoic acid;hydrochloride
InChI	InChI=1S/C9H11NO2.ClH/c1-6(10)7-4-2-3-5-8(7)9(11)12;/h2-6H,10H2,1H3,(H,11,12);1H
InChI Key	GEYYPUHNSHAXET-UHFFFAOYSA-N
MDL Number	MFCD12913677
Molecular Formula	C9H12ClNO2
Molecular Weight	201.6501
SMILES	Cl.C(C)(N)c1c(C(=O)O)cccc1
Synonyms	658683-12-6, 2-(1-Aminoethyl)benzoic acid hydrochloride, 2-(1-AMINO-ETHYL)-BENZOIC ACID HYDROCHLORIDE, 2-(1-Aminoethyl)benzoic acid HCl, SCHEMBL6093184, DTXSID30695842, 9995AH, MFCD12913677, AK156779, AS-55132, 2-(1-aminoethyl)benzoic acid;hydrochloride, AX8291015, Z-6592, 2-(1-Aminoethyl)benzoic acid--hydrogen chloride (1/1), 2-(1-Amino-ethyl)-benzoic acid hydrochloride, AldrichCPR, C9H11NO2.HCl, (R)-2-(1-Amino-ethyl)-benzoic acid hydrochloride, 1391433-88-7,

Complexity	170
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	201.056g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	201.65g/mol
Monoisotopic Mass	201.056g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	1
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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