AG001M8K

150009-58-8 | D-Aspartic acid, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, 4-(phenylmethyl) ester

AG001M8K

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CAS Number	150009-58-8
Catalog Number	AG001M8K(AGN-PC-0Q44IW)
Chemical Name	D-Aspartic acid, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, 4-(phenylmethyl) ester
IUPAC Name	(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxo-4-phenylmethoxybutanoic acid
InChI	InChI=1S/C26H23NO6/c28-24(32-15-17-8-2-1-3-9-17)14-23(25(29)30)27-26(31)33-16-22-20-12-6-4-10-18(20)19-11-5-7-13-21(19)22/h1-13,22-23H,14-16H2,(H,27,31)(H,29,30)/t23-/m1/s1
InChI Key	OQGAELAJEGGNKG-HSZRJFAPSA-N
MDL Number	MFCD00273445
Molecular Formula	C26H23NO6
Molecular Weight	445.4639
SMILES	O=C(O)[C@H](NC(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)=O)CC(OCC4=CC=CC=C4)=O
Synonyms	Fmoc-D-Asp(OBzl)-OH, 150009-58-8, MFCD00273445, J-300075, AK170196, Fmoc-L-aspartic acid -beta benzyl ester, KS-00000SYO, ZINC2564718, AKOS025289443, AC-6593, DS-7548, FCH3676846, D-Aspartic acid,N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, 4-(phenylmethyl) ester, 86060-84-6,

Complexity	668
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	445.153g/mol
Formal Charge	0
Heavy Atom Count	33
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	445.471g/mol
Monoisotopic Mass	445.153g/mol
Rotatable Bond Count	10
Topological Polar Surface Area	102A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4

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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