AG003C52

77119-85-8 | (R)-tert-Butyl (1-oxo-3-phenylpropan-2-yl)carbamate

AG003C52

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CAS Number	77119-85-8
Catalog Number	AG003C52(AGN-PC-0OHY1H)
Chemical Name	(R)-tert-Butyl (1-oxo-3-phenylpropan-2-yl)carbamate
IUPAC Name	tert-butyl N-[(2R)-1-oxo-3-phenylpropan-2-yl]carbamate
InChI	InChI=1S/C14H19NO3/c1-14(2,3)18-13(17)15-12(10-16)9-11-7-5-4-6-8-11/h4-8,10,12H,9H2,1-3H3,(H,15,17)/t12-/m1/s1
InChI Key	ZJTYRNPLVNMVPQ-GFCCVEGCSA-N
MDL Number	MFCD00274187
Molecular Formula	C14H19NO3
Molecular Weight	249.3056
SMILES	O=C(OC(C)(C)C)N[C@H](CC1=CC=CC=C1)C=O
Synonyms	77119-85-8, N-Boc-D-phenylalaninal, Boc-D-Phenylalaninal, (R)-(+)-2-(tert-Butoxycarbonylamino)-3-phenylpropanal, (R)-tert-Butyl (1-oxo-3-phenylpropan-2-yl)carbamate, N-Boc-2(R)-3-phenylpropanal, N-Boc-D-phenylalaninal, 97%, tert-butyl N-[(2R)-1-oxo-3-phenylpropan-2-yl]carbamate, tert-butyl [(2R)-1-oxo-3-phenylpropan-2-yl]carbamate, MFCD00801183, Carbamic acid, [(1R)-1-formyl-2-phenylethyl]-, 1,1-dimethylethyl ester, AK-45024, Boc-D-Phe-H, PubChem11217, PubChem15955, AC1Q1MTR, AC1Q1MTS, AC1Q1MTT, AC1ODT55, SCHEMBL1094506, CTK3J5088, KS-00000LKG, DTXSID00427253, ZJTYRNPLVNMVPQ-GFCCVEGCSA-N, ZINC2564775, ANW-59170, MFCD00274187, AKOS005146059, CB-3111, OR17577, TS-7041, AC-23792, ACM199336839, AJ-41057, AN-36860, ST058122, Boc-D-Phe-PAM resin (100-200 mesh), AX8047035, DB-031273, RT-002355, ST2408118, FT-0688451, X5488, (R)-2-t-butoxycarbonylamino-3-phenylpropanal, A-7974, tert-butyl (R)-1-formyl-2-phenylethyl carbamate, 119B858, A838961, (R)-alpha-(tert-Butoxycarbonylamino)benzenepropanal, I01-8901, tert-butyl N-[(1R)-1-benzyl-2-oxo-ethyl]carbamate, (R)-()-2-(tert-Butoxycarbonylamino)-3-phenylpropanal, (R)-tert-Butyl(1-oxo-3-phenylpropan-2-yl)carbamate, ((R)-1-Benzyl-2-oxo-ethyl)-carbamic acid t-butyl ester, (R)-2-(N-t-butoxycarbonylamino)-3-phenyl-propan-1-one, N-[(1R)-2-oxo-1-benzylethyl](tert-butoxy)carboxamide, ((R)-1-benzyl-2-oxo-ethyl)-carbamic acid tert-butyl ester, Boc-D-Phe-Merrifield Resin (100-200 mesh, > 0.5 mmol/g), N-[(2R)-1-oxo-3-phenylpropan-2-yl]carbamic acid tert-butyl ester, tert-butyl N-[(2R)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate, C14H19NO3, (R)-1-Boc-3-methylaminopyrrolidine, - -2- -3-PHENYLPROPANAL, ZINC01886491, ACN-037822, CB10129, CID7020444, (R)-1-Boc-3-(Methylamino)pyrrolidine hydrochloride, 1004538-35-5, 199336-83-9,

Complexity	277
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	249.136g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	249.31g/mol
Monoisotopic Mass	249.136g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	55.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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