AG01DU6B

1246509-66-9 | (S)-Methyl 3-Amino-2,3-Dihydro-1H-Indene-5-Carboxylate Hydrochloride

AG01DU6B

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CAS Number	1246509-66-9
Catalog Number	AG01DU6B
Chemical Name	(S)-Methyl 3-Amino-2,3-Dihydro-1H-Indene-5-Carboxylate Hydrochloride
IUPAC Name	methyl (3S)-3-amino-2,3-dihydro-1H-indene-5-carboxylate;hydrochloride
InChI	InChI=1S/C11H13NO2.ClH/c1-14-11(13)8-3-2-7-4-5-10(12)9(7)6-8;/h2-3,6,10H,4-5,12H2,1H3;1H/t10-;/m0./s1
InChI Key	RSENWQHYPMZMBK-PPHPATTJSA-N
MDL Number	MFCD22393235
Molecular Formula	C11H14ClNO2
Molecular Weight	227.6874
SMILES	O=C(C1=CC2=C(CC[C@@H]2N)C=C1)OC.[H]Cl
Synonyms	(S)-Methyl 3-amino-2,3-dihydro-1H-indene-5-carboxylate hydrochloride, 1246509-66-9, 1246509-67-0, KS-00000U2K, MFCD22393235, AKOS032954102, DS-20207, (R)-methyl 3-amino-2,3-dihydro-1H-indene-5-carboxylate hydrochloride,

Complexity	229
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	227.071g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	227.688g/mol
Monoisotopic Mass	227.071g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	52.3A^2
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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