AG01DDSG

2061996-49-2 | [(1S)-1-(4-chlorophenyl)ethyl]methylamine hydrochloride

AG01DDSG

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CAS Number	2061996-49-2
Catalog Number	AG01DDSG
Chemical Name	[(1S)-1-(4-chlorophenyl)ethyl]methylamine hydrochloride
IUPAC Name	(1S)-1-(4-chlorophenyl)-N-methylethanamine;hydrochloride
InChI	InChI=1S/C9H12ClN.ClH/c1-7(11-2)8-3-5-9(10)6-4-8;/h3-7,11H,1-2H3;1H/t7-;/m0./s1
InChI Key	FNFAFYJSZXBEBR-FJXQXJEOSA-N
MDL Number	MFCD30537782
Molecular Formula	C9H13Cl2N
Molecular Weight	206.1122
SMILES	C[C@H](NC)C1=CC=C(Cl)C=C1.[H]Cl
Synonyms	2061996-49-2, (S)-1-(4-Chlorophenyl)-N-methylethanamine hydrochloride, (S)-1-(4-CHLOROPHENYL)-N-METHYLETHANAMINE HCL, KS-00000U2W, DS-19780, [(1S)-1-(4-CHLOROPHENYL)ETHYL]METHYLAMINE HYDROCHLORIDE,

Complexity	108
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	205.042505g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	206.11g/mol
Monoisotopic Mass	205.042505g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	12Ų
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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