AG006VZR

501015-29-8 | Fmoc-(s)-3-amino-3-(3-methoxy-phenyl)-propionic acid

AG006VZR

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CAS Number	501015-29-8
Catalog Number	AG006VZR(AGN-PC-0OB6IY)
Chemical Name	Fmoc-(s)-3-amino-3-(3-methoxy-phenyl)-propionic acid
IUPAC Name	(3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(3-methoxyphenyl)propanoic acid
InChI	InChI=1S/C25H23NO5/c1-30-17-8-6-7-16(13-17)23(14-24(27)28)26-25(29)31-15-22-20-11-4-2-9-18(20)19-10-3-5-12-21(19)22/h2-13,22-23H,14-15H2,1H3,(H,26,29)(H,27,28)/t23-/m0/s1
InChI Key	SOJXDPVBOJLSIA-QHCPKHFHSA-N
MDL Number	MFCD03427975
Molecular Formula	C25H23NO5
Molecular Weight	417.4538
SMILES	O=C(O)C[C@H](NC(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)=O)C4=CC=CC(OC)=C4
Synonyms	501015-29-8, (S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(3-methoxyphenyl)propanoic acid, Fmoc-(S)-3-Amino-3-(3-methoxy-phenyl)-propionic acid, Fmoc-(S)-3-amino-3-(3-methoxyphenyl)propionic acid, Fmoc-(S)- 3-Amino-3-(3-methoxyphenyl)-propionic acid, Fmoc-?-Phe(3-Ome)-OH, AC1ODZLA, PubChem24034, CTK4J2152, DTXSID00427495, ZINC2585868, 6843AB, MFCD03427975, AB15271, CF-1235, AC-25435, ACM501015298, AJ-43628, AK114953, BBV-38260225, PS-12482, AX8130778, RT-012830, A-8614, Fmoc-(S)-3-Amino-3-(3-methoxy-phenyl)propionic acid, Fmoc-(S)-3-Amino-3-(3-methoxyphenyl)-propionic acid, fmoc-(S)-3-amino-3-(3-methoxy-phenyl)-propionic acid, AldrichCPR, (3S)-3-({[(9H-Fluoren-9-yl)methoxy]carbonyl}amino)-3-(3-methoxyphenyl)propanoic acid, (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(3-methoxyphenyl)propanoic acid, (3S)-3-[(FLUOREN-9-YLMETHOXY)CARBONYLAMINO]-3-(3-METHOXYPHENYL)PROPANOIC ACID, C25H23NO5, CID7023343, FMOC- -3-AMINO-3- -PROPIONICACID, 3-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(3-methoxyphenyl)propanoic Acid,

Complexity	603
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	417.158g/mol
Formal Charge	0
Heavy Atom Count	31
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	417.461g/mol
Monoisotopic Mass	417.158g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	84.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H332
Packing Group
Precautionary statements	P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
UN Code

Certificate of Analysis

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