AG007MJC

268542-15-0 | Boc-(r,s)-3-amino-3-(2-naphthyl)-propionic acid

AG007MJC

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CAS Number	268542-15-0
Catalog Number	AG007MJC(AGN-PC-0R2RCZ)
Chemical Name	Boc-(r,s)-3-amino-3-(2-naphthyl)-propionic acid
IUPAC Name	3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid
InChI	InChI=1S/C18H21NO4/c1-18(2,3)23-17(22)19-15(11-16(20)21)14-9-8-12-6-4-5-7-13(12)10-14/h4-10,15H,11H2,1-3H3,(H,19,22)(H,20,21)
InChI Key	NCQJBPXXRXOIJD-UHFFFAOYSA-N
MDL Number	MFCD02090688
Molecular Formula	C18H21NO4
Molecular Weight	315.3636
SMILES	O=C(O)CC(NC(OC(C)(C)C)=O)C1=CC=C2C=CC=CC2=C1
Synonyms	268542-15-0, Boc-(R,S)-3-amino-3-(2-naphthyl)propionic acid, Boc-(r,s)-3-amino-3-(2-naphthyl)-propionic acid, Boc-(R,S)-3-amino-3-(2-naphthyl)-proponicacid, 3-((tert-Butoxycarbonyl)amino)-3-(naphthalen-2-yl)propanoic acid, AC1MBSJS, Boc-3-Amino-3-(2-naphthyl)propionic acid, SCHEMBL13802924, (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid, 6217AH, MFCD02090688, ACM268542150, RT-011631, A-7514, Boc-(R,S)-3-amino-3-(2-naphthyl)-proponic acid, 3-tert-Butoxycarbonylamino-3-naphthalen-2-yl-propionic acid, 3-(tert-butoxycarbonylamino)-3-(naphthalen-2-yl)propanoic acid, 3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid, (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid, C18H21NO4, Boc- -3-amino-3- -proponicacid, CID2755990, (R)-3-((tert-Butoxycarbonyl)amino)-3-(naphthalen-2-yl)propanoic acid, (S)-3-((tert-Butoxycarbonyl)amino)-3-(naphthalen-2-yl)propanoic acid, 3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-yl-propanoic Acid, 500770-69-4, 500789-01-5,

Complexity	429
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	315.147g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	315.369g/mol
Monoisotopic Mass	315.147g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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