AG0034JH

218608-83-4 | (R)-3-((tert-Butoxycarbonyl)amino)-5-phenylpentanoic acid

AG0034JH

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CAS Number	218608-83-4
Catalog Number	AG0034JH(AGN-PC-0QYDWB)
Chemical Name	(R)-3-((tert-Butoxycarbonyl)amino)-5-phenylpentanoic acid
IUPAC Name	(3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenylpentanoic acid
InChI	InChI=1S/C16H23NO4/c1-16(2,3)21-15(20)17-13(11-14(18)19)10-9-12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3,(H,17,20)(H,18,19)/t13-/m1/s1
InChI Key	MYWZFJXOLAXENE-CYBMUJFWSA-N
MDL Number	MFCD01076262
Molecular Formula	C16H23NO4
Molecular Weight	293.3581
SMILES	C(C)(C)(C)OC(=O)N[C@@H](CC(=O)O)CCC1=CC=CC=C1
Synonyms	1(S),3(R)-dihydroxy-20(R)-(4-hydroxy-4-trifluoromethyl-5,5-5-trif-luoro-1-pent-2-ynyloxymethyl)-9,10-sero-pregna-5(Z),7(E),10(19)-triene-alpha,25(OH)2D3, CB 1267, CB-1267, CB1267, 218608-83-4, (R)-3-((tert-Butoxycarbonyl)amino)-5-phenylpentanoic acid, (R)-3-(Boc-amino)-5-phenylpentanoic acid, MFCD01076262, (3R)-3-(tert-butoxycarbonylamino)-5-phenyl-pentanoic acid, (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenylpentanoic acid, Boc-(S)-Amino-5-phenyl-pentanoic acid, 218608-84-5, AC1ODVLV, SCHEMBL825574, Boc-D-?-Nva(5-Phenyl)-OH, ZINC2572717, ANW-73953, AKOS015890047, CB-1267, AC-22144, ACM218608834, AJ-42079, AK106274, AN-29511, PS-12268, AX8041459, N-Boc-3-(R)-amino-5-phenylpentanoic acid, TC-162698, TR-010242, FT-0657176, 608B834, I01-5123, (3R)-3-(tert-butoxycarbonylamino)-5-phenyl-valeric acid, n-tert-butoxycarbonyl-3(r)-amino-5-phenylpentanoic acid, (3R)-3-[(tert-butoxycarbonyl)amino]-5-phenylpentanoic acid, (R)-3-(Boc-amino)-5-phenylpentanoic acid, >=97.0% (HPLC), (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenyl-pentanoic acid, (3R)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-phenylpentanoic acid, Boc-(R)-3-Amino-5-phenylpentanoic acid, Boc-(R)-3-Amino-5-phenyl-pentanoic acid, MFCD01076264, CID7021558, (R)-3-((tert-Butoxycarbonyl)amino)-5-phenylpentanoicacid, (R)-3-(Boc-amino)-5-phenylpentanoic acid, 97% - 1G 1g, 3-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenyl-pentanoic Acid,

Complexity	343
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	293.163g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	293.363g/mol
Monoisotopic Mass	293.163g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313-P362-P403+P233-P405-P501
UN Code

Certificate of Analysis

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