AG009B18

135944-05-7 | Fmoc-Alpha-Methyl-L-Phe

AG009B18

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CAS Number	135944-05-7
Catalog Number	AG009B18(AGN-PC-0PKQV1)
Chemical Name	Fmoc-Alpha-Methyl-L-Phe
IUPAC Name	(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-3-phenylpropanoic acid
InChI	InChI=1S/C25H23NO4/c1-25(23(27)28,15-17-9-3-2-4-10-17)26-24(29)30-16-22-20-13-7-5-11-18(20)19-12-6-8-14-21(19)22/h2-14,22H,15-16H2,1H3,(H,26,29)(H,27,28)/t25-/m0/s1
InChI Key	KLBKBAAOPOXFSK-VWLOTQADSA-N
MDL Number	MFCD02682285
Molecular Formula	C25H23NO4
Molecular Weight	401.4544
SMILES	O=C(O)[C@@](C)(NC(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)=O)CC4=CC=CC=C4
Synonyms	135944-05-7, Fmoc-alpha-methyl-L-phenylalanine, (S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-2-methyl-3-phenylpropanoic acid, Fmoc-alpha-methyl-L-Phe, Fmoc-alpha-benzyl-L-Ala, AK-58497, (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-3-phenylpropanoic acid, (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-3-phenyl-propanoic Acid, (S)-2-(((9H-fluoren-9-yl)methoxy)carbonylamino)-2-methyl-3-phenylpropanoic acid, (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-3-phenyl-propionic acid, (2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-2-methyl-3-phenylpropanoic acid, Fmoc-L-alpha-Methyl-Phenylalanine, N-Fmoc-2-amino-2-methyl-3-phenylpropionic acid, AC1MC6MI, Fmoc-a-methyl-L-phenylalanine, SCHEMBL12297754, CTK7G2328, ZINC2583020, ANW-73487, MFCD02682285, AKOS015837087, RTR-062106, AJ-43173, DS-16160, AX8130899, TR-062106, A-7715, Fmoc-|A inverted exclamation mark-benzyl-L-Ala, Fmoc-(S)-2-amino-2- methyl-3-phenylpropanoic acid, J-006787, (S)-N-FMOC-alpha-Methylphenylalanine sesquihydrate, 98%, 98% ee, (2S)-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-2-methyl-3-phenylpropanoic acid, KLBKBAAOPOXFSK-VWLOTQADSA-N, ACN-036758, CID2762288, 152436-04-9, N/A,

Complexity	594
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	401.163g/mol
Formal Charge	0
Heavy Atom Count	30
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	401.462g/mol
Monoisotopic Mass	401.163g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.8

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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