AG009G6K

133492-69-0 | (S)-1-(2,4-Dichlorophenyl)ethanamine

AG009G6K

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CAS Number	133492-69-0
Catalog Number	AG009G6K(AGN-PC-0PK0V2)
Chemical Name	(S)-1-(2,4-Dichlorophenyl)ethanamine
IUPAC Name	(1S)-1-(2,4-dichlorophenyl)ethanamine
InChI	InChI=1S/C8H9Cl2N/c1-5(11)7-3-2-6(9)4-8(7)10/h2-5H,11H2,1H3/t5-/m0/s1
InChI Key	OUVZHZAOWDHBOU-YFKPBYRVSA-N
MDL Number	MFCD06761787
Molecular Formula	C8H9Cl2N
Molecular Weight	190.0698
SMILES	ClC1=C(C=CC(=C1)Cl)[C@H](C)N
Synonyms	(S)-1-(2,4-Dichlorophenyl)ethanamine, 133492-69-0, (1S)-1-(2,4-dichlorophenyl)ethanamine, AC1M8XOR, AC1Q29II, SCHEMBL5492924, CTK6G7775, DTXSID40368818, ZINC3378499, 6092AA, ANW-72021, MFCD06761787, EBD2221478, AJ-44949, TX-017428, (1S)-1-(2,4-dichlorophenyl)ethan-1-amine, (S)-2,4-Dichloro-a-methyl-benzenemethanamine, EN300-87772, I14-36872, C8H9Cl2N, Benzenemethanamine, 2,4-dichloro-, (S)-1-(2,4-Dichlorophenyl)ethamine, CID2496562, SMR000264764,

Complexity	129
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	189.011g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	190.067g/mol
Monoisotopic Mass	189.011g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

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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