AG000U9F

130304-80-2 | L-Aspartic acid, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, 4-cyclohexyl ester

AG000U9F

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CAS Number	130304-80-2
Catalog Number	AG000U9F(AGN-PC-0PJ7CZ)
Chemical Name	L-Aspartic acid, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, 4-cyclohexyl ester
IUPAC Name	(2S)-4-cyclohexyloxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxobutanoic acid
InChI	InChI=1S/C25H27NO6/c27-23(32-16-8-2-1-3-9-16)14-22(24(28)29)26-25(30)31-15-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h4-7,10-13,16,21-22H,1-3,8-9,14-15H2,(H,26,30)(H,28,29)/t22-/m0/s1
InChI Key	OCMZRMNYEXIKQI-QFIPXVFZSA-N
MDL Number	MFCD00135420
Molecular Formula	C25H26NO6
Molecular Weight	436.4770
SMILES	C1=CC=CC=2C3=CC=CC=C3C(C12)COC(=O)N[C@@H](CC(=O)[O-])C(=O)OC1CCCCC1
Synonyms	Fmoc-Asp(OcHex)-OH, 130304-80-2, Fmoc-Asp(OcHx)-OH, (S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(cyclohexyloxy)-4-oxobutanoic acid, MFCD00135420, N-alpha-(9-Fluorenylmethyloxycarbonyl)-L-aspartic acid beta-cyclohexyl ester, fmoc-l-asp(chx)-oh, fmoc-l-asp(ochx)-oh, PubChem18985, fmoc-aspartic acid(ochex), CTK8B7909, DTXSID40662449, ZINC2508186, ANW-58917, CF-174, AKOS015922865, AKOS016002008, CS-W014375, RTR-004133, VA50284, AJ-36267, AK-57354, AN-32342, Fmoc-L-aspartic acid beta-cyclohexyl ester, AB0088944, AX8008580, fmoc-l-asparatic acid-beta-cyclohexyl ester, A7861, FT-0643126, ST24035794, 304F802, C-22332, (2S)-4-(cyclohexoxy)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxo-butanoic acid, (2S)-4-cyclohexyloxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxobutanoic acid, (S)-2-(((9H-fluoren-9-yl)methoxy)carbonylamino)-4-(cyclohexyloxy)-4-oxobutanoic acid, (2S)-4-(Cyclohexyloxy)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-oxobutanoic acid (non-preferred name), Fmoc-L-aspartic acid 4-cyclohexyl ester, Fmoc-Asp(OcHex)-OH, 99% - 1G 1g, N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-L-Aspartic acid 4-cyclohexyl ester,

Complexity	653
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	437.184g/mol
Formal Charge	0
Heavy Atom Count	32
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	437.492g/mol
Monoisotopic Mass	437.184g/mol
Rotatable Bond Count	9
Topological Polar Surface Area	102A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.3

GHS Hazard and Precautionary Statements

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

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