AG007M6Z

270063-38-2 | (S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(naphthalen-1-yl)butanoic acid

AG007M6Z

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CAS Number	270063-38-2
Catalog Number	AG007M6Z(AGN-PC-0R2WLG)
Chemical Name	(S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(naphthalen-1-yl)butanoic acid
IUPAC Name	(3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-naphthalen-1-ylbutanoic acid
InChI	InChI=1S/C29H25NO4/c31-28(32)17-21(16-20-10-7-9-19-8-1-2-11-22(19)20)30-29(33)34-18-27-25-14-5-3-12-23(25)24-13-4-6-15-26(24)27/h1-15,21,27H,16-18H2,(H,30,33)(H,31,32)/t21-/m0/s1
InChI Key	QKDVUQGMQTZWKV-NRFANRHFSA-N
MDL Number	MFCD01861034
Molecular Formula	C29H25NO4
Molecular Weight	451.5131
SMILES	O=C(O)C[C@@H](NC(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)=O)CC4=C5C=CC=CC5=CC=C4
Synonyms	270063-38-2, Fmoc-(S)-3-Amino-4-(1-naphthyl)-butyric acid, (S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(naphthalen-1-yl)butanoic acid, (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-naphthalen-1-ylbutanoic acid, Fmoc-?-Homoala(1-Naphthyl)-OH, Fmoc-(R)-3-Amino-4-(1-naphthyl)-butyric acid, AC1MC5DA, SCHEMBL118132, ZINC2385962, Fmoc-(1-naphthyl)-L-ss-homoalanine, CF-433, MFCD01861034, (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-naphthalen-1-yl-butanoic Acid, AKOS015948811, AC-22117, ACM270063382, AJ-35259, AK114853, CC-28554, PS-12045, AX8001923, RT-012752, CS-0062186, FT-0644262, A-8785, C-22495, (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-(1-naphthyl)butanoic acid, (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-(1-naphthyl)butyric acid, (3S)-3-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-(1-naphthalenyl)butanoic acid, (3S)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-4-(naphthalen-1-yl)butanoic acid, (S)-3-(((9H-fluoren-9-yl)methoxy)carbonylamino)-4-(naphthalen-1-yl)butanoic acid, Fmoc-(1-naphthyl)-L-beta-homoalanine, CID2761620, Fmoc-(S)-3-amino-4-(1-naphthyl)butanoic acid, 1-Naphthalenebutanoic acid, beta-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (betaS)-, 269398-89-2,

Complexity	688
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	451.178g/mol
Formal Charge	0
Heavy Atom Count	34
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	451.522g/mol
Monoisotopic Mass	451.178g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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