AG002QL1

251317-00-7 | D-Alanine, 3-amino-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-

AG002QL1

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CAS Number	251317-00-7
Catalog Number	AG002QL1(AGN-PC-0R0UTH)
Chemical Name	D-Alanine, 3-amino-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-
IUPAC Name	(2R)-3-amino-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
InChI	InChI=1S/C18H18N2O4/c19-9-16(17(21)22)20-18(23)24-10-15-13-7-3-1-5-11(13)12-6-2-4-8-14(12)15/h1-8,15-16H,9-10,19H2,(H,20,23)(H,21,22)/t16-/m1/s1
InChI Key	HDSLKWZYHRLRRL-MRXNPFEDSA-N
MDL Number	MFCD01318733
Molecular Formula	C18H18N2O4
Molecular Weight	326.3465
SMILES	O=C(O)[C@H](NC(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)=O)CN
Synonyms	251317-00-7, Fmoc-D-Dap-OH, (R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-aminopropanoic acid, 3-amino-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-D-Alanine, AC1LEMHE, (2R)-3-amino-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid, SCHEMBL15806915, CTK8C5142, ZINC57604, DTXSID80350934, ANW-74341, MFCD01318733, AKOS016843577, FCH4040610, N-a-Fmoc-D-2,3-diaminopropionic acid, RTR-011503, AJ-09749, AX8032870, DB-067321, FT-0679763, I04-1260, I14-15380, 3-Amino-N-{[(9H-fluoren-9-yl)methoxy]carbonyl}-D-alanine, D-Alanine, 3-amino-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, N-alpha-(9-Fluorenylmethyloxycarbonyl)-D-2,3-diaminopropionic acid, (2R)-3-amino-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoic acid, FMOC-D-DAP-OHHCL, CID688639, 3-amino-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic Acid, (R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-aminopropanoicacid,

Complexity	448
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	326.127g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	326.352g/mol
Monoisotopic Mass	326.127g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	102A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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