AG002708

179417-69-7 | 2-((Tert-Butoxycarbonyl)Amino)-2-(2-Methoxyphenyl)Acetic Acid

AG002708

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CAS Number	179417-69-7
Catalog Number	AG002708(AGN-PC-0QBKB7)
Chemical Name	2-((Tert-Butoxycarbonyl)Amino)-2-(2-Methoxyphenyl)Acetic Acid
IUPAC Name	2-(2-methoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid
InChI	InChI=1S/C14H19NO5/c1-14(2,3)20-13(18)15-11(12(16)17)9-7-5-6-8-10(9)19-4/h5-8,11H,1-4H3,(H,15,18)(H,16,17)
InChI Key	KRHZKJYHTQGZGS-UHFFFAOYSA-N
MDL Number	MFCD06797221
Molecular Formula	C14H19NO5
Molecular Weight	281.3044
SMILES	O=C(O)C(NC(OC(C)(C)C)=O)C1=CC=CC=C1OC
Synonyms	179417-69-7, Boc-DL-(2-methoxyphenyl)glycine, 2-((tert-Butoxycarbonyl)amino)-2-(2-methoxyphenyl)acetic acid, [(tert-butoxycarbonyl)amino](2-methoxyphenyl)acetic acid, 2-{[(tert-butoxy)carbonyl]amino}-2-(2-methoxyphenyl)acetic acid, KRHZKJYHTQGZGS-UHFFFAOYSA-N, SCHEMBL265969, (2R)-2-(2-methoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid, (2S)-2-(2-methoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid, 6003AD, MFCD06797221, AKOS013463976, RTR-008234, BS-12276, TR-008234, FT-0679745, alpha-(Boc-amino)-2-methoxybenzeneacetic acid, EN300-79089, Z-1754, [(t-Butoxycarbonyl)amino](2-methoxyphenyl)acetic acid, I14-41099, tert-Butoxycarbonylamino-(2-methoxy-phenyl)-acetic acid, Z2429425738, 2-(2-methoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid, Benzeneacetic acid, alpha-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methoxy-, Benzeneacetic acid,a-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methoxy-, C14H19NO5, a-(Boc-amino)-2-methoxybenzeneacetic acid, (R)-2-((tert-Butoxycarbonyl)amino)-2-(2-methoxyphenyl)acetic acid, (S)-2-((tert-Butoxycarbonyl)amino)-2-(2-methoxyphenyl)acetic acid, 1217710-00-3, 1217786-73-6, (2R)-[(tert-butoxycarbonyl)amino](2-methoxyphenyl)ethanoic acid, (2S)-[(tert-butoxycarbonyl)amino](2-methoxyphenyl)ethanoic acid,

Complexity	350
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	281.126g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	281.308g/mol
Monoisotopic Mass	281.126g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	84.9A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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