AG003OHP

218943-30-7 | Boc-l-beta-homoglutamic acid 6-benzyl ester

AG003OHP

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CAS Number	218943-30-7
Catalog Number	AG003OHP(AGN-PC-0QYEUP)
Chemical Name	Boc-l-beta-homoglutamic acid 6-benzyl ester
IUPAC Name	(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxo-6-phenylmethoxyhexanoic acid
InChI	InChI=1S/C18H25NO6/c1-18(2,3)25-17(23)19-14(11-15(20)21)9-10-16(22)24-12-13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3,(H,19,23)(H,20,21)/t14-/m0/s1
InChI Key	JABNOCWCLLYHKE-AWEZNQCLSA-N
MDL Number	MFCD01862936
Molecular Formula	C18H25NO6
Molecular Weight	351.3942
SMILES	O=C(O)C[C@@H](NC(OC(C)(C)C)=O)CCC(OCC1=CC=CC=C1)=O
Synonyms	218943-30-7, Boc-beta-Hoglu(Obzl)-OH, Boc-L-beta-homoglutamic acid 6-benzyl ester, Boc-L-beta-homoglutamic acid(OBzl), MFCD01862936, Boc-beta-Homoglu(OBzl)-OH, (S)-6-(benzyloxy)-3-((tert-butoxycarbonyl)amino)-6-oxohexanoic acid, (3S)-6-benzyloxy-3-(tert-butoxycarbonylamino)-6-oxo-hexanoic acid, (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxo-6-phenylmethoxyhexanoic acid, Fmoc-L-beta-Homo-Glu(OBzl)-OH, AK-89145, Boc-?-HoGlu(OBzl)-OH, AC1MC54P, SCHEMBL17513638, KS-00000J3Y, ZINC2386866, Boc-L-beta-Homoglutamic acid (OBzl), Boc-a degrees (3/4)-HoGlu(OBzl)-OH, AC-22071, ACM218943307, AJ-35396, AN-29526, DS-18580, AX8019414, Boc-L-|A-Homoglutamic acid 6-benzyl ester, TR-010265, A7557, FT-0696174, ST24046206, Z5764, K-6209, N-Boc-L-beta-homoglutamic acid 6-benzyl ester, Boc-beta-Homoglu(OBzl)-OH, >=98.0% (TLC), 943B307, (S)-3-(Boc-amino)adipic acid 6-benzyl ester, 95%, (3S)-3-(tert-butoxycarbonylamino)hexanedioic acid 6-benzyl ester, (3S)-3-tert-butoxycarbonylamino-5-benzyloxycarbonylpentanoic acid, (3S)-6-benzoxy-3-(tert-butoxycarbonylamino)-6-keto-hexanoic acid, (3S)-6-(benzyloxy)-3-[(tert-butoxycarbonyl)amino]-6-oxohexanoic acid, (S)-3-[(tert-Butyloxycarbonyl)amino]-6-oxo-6-(benzyloxy)hexanoic acid, (3S)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxo-6-phenylmethoxyhexanoic acid, (3S)-6-(Benzyloxy)-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-6-oxohexanoic acid, (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-6-phenylmethoxy-hexanoic acid, Boc-|A-HoGlu(OBzl)-OH, C18H25NO6, JABNOCWCLLYHKE-AWEZNQCLSA-N, Boc-beta-HoGlu(OBzl)-OH - 1G 1g, ACN-026184, CID2761517, (S)-3-(Boc-amino)adipic acid 6-benzyl ester, Hexanedioic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-, 6-(phenylmethyl) ester, (3S)-, 3-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxo-6-phenylmethoxy-hexanoic Acid,

Complexity	451
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	351.168g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	351.399g/mol
Monoisotopic Mass	351.168g/mol
Rotatable Bond Count	11
Topological Polar Surface Area	102A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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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