AG00GV95

941296-80-6 | Fmoc-N-Me-Asn(Trt)-OH

AG00GV95

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CAS Number	941296-80-6
Catalog Number	AG00GV95(AGN-PC-0WAK62)
Chemical Name	Fmoc-N-Me-Asn(Trt)-OH
IUPAC Name	(2S)-2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]-4-oxo-4-(tritylamino)butanoic acid
InChI	InChI=1S/C39H34N2O5/c1-41(38(45)46-26-34-32-23-13-11-21-30(32)31-22-12-14-24-33(31)34)35(37(43)44)25-36(42)40-39(27-15-5-2-6-16-27,28-17-7-3-8-18-28)29-19-9-4-10-20-29/h2-24,34-35H,25-26H2,1H3,(H,40,42)(H,43,44)/t35-/m0/s1
InChI Key	YZBDIRBPZCFMAZ-DHUJRADRSA-N
MDL Number	MFCD22200773
Molecular Formula	C39H34N2O5
Molecular Weight	610.6977
SMILES	O=C(O)[C@@H](N(C(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)=O)C)CC(NC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)=O
Synonyms	Fmoc-N-Me-Asn(Trt)-OH, 941296-80-6, (S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)(methyl)amino)-4-oxo-4-(tritylamino)butanoic acid, KS-00000PKK, ZINC97957274, AKOS027325806, Fmoc-N-Me-Asn(Trt)-OH, 97% (HPLC),

Complexity	962
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	610.247g/mol
Formal Charge	0
Heavy Atom Count	46
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	610.71g/mol
Monoisotopic Mass	610.247g/mol
Rotatable Bond Count	11
Topological Polar Surface Area	95.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	6.8

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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