AG00CIXS

39959-66-5 | (+/-)-2,3-DICHLORO-ALPHA-METHYLBENZYLAMINE HYDROCHLORIDE

AG00CIXS

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CAS Number	39959-66-5
Catalog Number	AG00CIXS(AGN-PC-00IQS7)
Chemical Name	(+/-)-2,3-DICHLORO-ALPHA-METHYLBENZYLAMINE HYDROCHLORIDE
IUPAC Name	1-(2,3-dichlorophenyl)ethanamine;hydrochloride
InChI	InChI=1S/C8H9Cl2N.ClH/c1-5(11)6-3-2-4-7(9)8(6)10;/h2-5H,11H2,1H3;1H
InChI Key	FQTXPVLCCDQRHY-UHFFFAOYSA-N
MDL Number	MFCD00055225
Molecular Formula	C8H10Cl3N
Molecular Weight	226.5307
SMILES	NC(C)C1=CC=CC(Cl)=C1Cl.[H]Cl
Synonyms	2,3-dichloro-alpha-methylbenzylamine, 2,3-dichloro-alpha-methylbenzylamine, (+)-isomer, 2,3-dichloro-alpha-methylbenzylamine, (+-)-isomer, 2,3-dichloro-alpha-methylbenzylamine, (-)-isomer, 2,3-dichloro-alpha-methylbenzylamine, hydrochloride, 2,3-dichloro-alpha-methylbenzylamine, hydrochloride, (+-)-isomer, Lilly 78335, LY 78335, 39959-66-5, 1-(2,3-Dichlorophenyl)ethanamine hydrochloride, LY 78335, LY 78335 hydrochloride, (+/-)-2,3-Dichloro-alpha-methylbenzylamine hydrochloride, EU-0100476, SCHEMBL1321451, CHEMBL1255749, CTK8F1484, KS-00000TZV, DTXSID80474684, DCMB hydrochloride; LY-78335, Tox21_500476, MFCD00055225, 1-(2,3-dichlorophenyl)ethanamine hcl, AKOS024457957, CCG-221780, LP00476, ACM39959665, NCGC00093885-01, NCGC00093885-02, NCGC00261161-01, AK555588, DS-19653, D-103, 1-(2,3-dichlorophenyl)ethanamine;hydrochloride, 2,3-Dichloro-?-methylbenzylamine hydrochloride, SR-01000075609, SR-01000075609-1, (?)-2,3-Dichloro-alpha-methylbenzylamine hydrochloride, (y)-2,3-Dichloro-alpha-methylbenzylamine hydrochloride, ( inverted question mark)-2,3-Dichloro-alpha-methylbenzylamine hydrochloride, CID11957540, -2,3-DICHLORO-ALPHA-METHYLBENZYLAMINEHYDROCHLORIDE, 1-(2,3-DICHLOROPHENYL)ETHAN-1-AMINE HYDROCHLORIDE, 39226-94-3,

Complexity	129
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	224.988g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	226.525g/mol
Monoisotopic Mass	224.988g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26A^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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