AG0014JB

1332832-16-2 | (S)-1-O-Tolylethanamine-hcl

AG0014JB

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CAS Number	1332832-16-2
Catalog Number	AG0014JB(AGN-PC-0WANFL)
Chemical Name	(S)-1-O-Tolylethanamine-hcl
IUPAC Name	(1S)-1-(2-methylphenyl)ethanamine;hydrochloride
InChI	InChI=1S/C9H13N.ClH/c1-7-5-3-4-6-9(7)8(2)10;/h3-6,8H,10H2,1-2H3;1H/t8-;/m0./s1
InChI Key	VNGAKUOLRVQVHG-QRPNPIFTSA-N
MDL Number	MFCD11101268
Molecular Formula	C9H14ClN
Molecular Weight	171.6672
SMILES	C[C@H](N)C1=CC=CC=C1C.[H]Cl
Synonyms	(S)-1-(o-Tolyl)ethanamine hydrochloride, 1332832-16-2, (S)-1-O-TOLYLETHANAMINE-HCl, (S)-1-O-Tolylethanamine hydrochloride, AK162902, KS-00000SNC, MFCD11101268, AKOS015923166, AB0000511, W8323, A19150, S-1245, I01-6068, (1S)-1-(2-METHYLPHENYL)ETHAN-1-AMINE HYDROCHLRIDE, (S)-1-o-tolylethanamine, C9H14ClN, 76279-30-6,

Complexity	101
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	171.081g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	171.668g/mol
Monoisotopic Mass	171.081g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

Lot Number