AG003ACK

2717-76-2 | N-Benzyloxycarbonyl-L-tryptophan methyl ester

AG003ACK

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CAS Number	2717-76-2
Catalog Number	AG003ACK(AGN-PC-0R2ZWX)
Chemical Name	N-Benzyloxycarbonyl-L-tryptophan methyl ester
IUPAC Name	methyl (2S)-3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoate
InChI	InChI=1S/C20H20N2O4/c1-25-19(23)18(11-15-12-21-17-10-6-5-9-16(15)17)22-20(24)26-13-14-7-3-2-4-8-14/h2-10,12,18,21H,11,13H2,1H3,(H,22,24)/t18-/m0/s1
InChI Key	DYWXSVJXETXGGQ-SFHVURJKSA-N
MDL Number	MFCD06658545
Molecular Formula	C20H20N2O4
Molecular Weight	352.3838
SMILES	COC([C@@H](NC(=O)OCC1=CC=CC=C1)CC1=CNC2=CC=CC=C12)=O
Synonyms	Z-TRP-OME, 2717-76-2, (S)-Methyl 2-(((benzyloxy)carbonyl)amino)-3-(1H-indol-3-yl)propanoate, AK-50336, Cbz-L-Trp-OMe, 99%, cbz-l-tryptophan methyl ester, SCHEMBL1318661, DYWXSVJXETXGGQ-SFHVURJKSA-N, CZ-082, ZINC39418958, AKOS015914133, ACM2717762, KS-00000L79, DS-15389, AJ-100257, N-Benzyloxycarbonyl-L-tryptophan methyl ester, ST24036302, (S)-N-benzyloxycarbonyl-L-tryptophan methyl ester, L-Tryptophan,N-[(phenylmethoxy)carbonyl]-, methyl ester, Cbz-L-Trp-OMe, 99% - 5G 5g, CID11256670, (+)-N-[(Phenylmethoxy)carbonyl]-L-tryptophan methyl ester, Methyl (2R)-3-(1H-indol-3-yl)-2-phenylmethoxycarbonylamino-propanoate,

Complexity	478
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	352.142g/mol
Formal Charge	0
Heavy Atom Count	26
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	352.39g/mol
Monoisotopic Mass	352.142g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	80.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

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

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