AG00HRMD

1269634-11-8 | methyl DL-3-amino-3-(3-methoxyphenyl)propanoate hydrochloride

AG00HRMD

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CAS Number	1269634-11-8
Catalog Number	AG00HRMD
Chemical Name	methyl DL-3-amino-3-(3-methoxyphenyl)propanoate hydrochloride
IUPAC Name	methyl 3-amino-3-(3-methoxyphenyl)propanoate;hydrochloride
InChI	InChI=1S/C11H15NO3.ClH/c1-14-9-5-3-4-8(6-9)10(12)7-11(13)15-2;/h3-6,10H,7,12H2,1-2H3;1H
InChI Key	NVKLERNXNLLGLM-UHFFFAOYSA-N
MDL Number	MFCD06740363
Molecular Formula	C11H16ClNO3
Molecular Weight	245.7026
SMILES	O=C(OC)CC(N)C1=CC=CC(OC)=C1.[H]Cl
Synonyms	1269634-11-8, Methyl 3-amino-3-(3-methoxyphenyl)propanoate hydrochloride, methyl DL-3-amino-3-(3-methoxyphenyl)propanoate hydrochloride, 669087-27-8, CTK6J1772, KS-00000TPN, ZX-AV000627, 3-AMINO-3-(3-METHOXY-PHENYL)-PROPIONIC ACID METHYL ESTER HCL, MFCD06740363, AKOS030242636, AK544245, DS-19305, Methyl 3-amino-3-(3-methoxyphenyl)propanoate HCl, METHYL (R)-3-AMINO-3-(3-METHOXYPHENYL)PROPANOATE HCL, 3-Amino-3-(3-methoxy-phenyl)-propionic acid methyl ester hydrochloride, 3-AMINO-3-(3-METHOXY-PHENYL)-PROPIONIC ACID METHYLESTER HYDROCHLORIDE,

Complexity	208
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	245.082g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	245.703g/mol
Monoisotopic Mass	245.082g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	61.6A^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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