AG002249

180576-05-0 | 1-Piperazineacetic acid, 4-[(9H-fluoren-9-ylmethoxy)carbonyl]-

AG002249

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CAS Number	180576-05-0
Catalog Number	AG002249(AGN-PC-0IBWUK)
Chemical Name	1-Piperazineacetic acid, 4-[(9H-fluoren-9-ylmethoxy)carbonyl]-
IUPAC Name	2-[4-(9H-fluoren-9-ylmethoxycarbonyl)piperazin-1-yl]acetic acid
InChI	InChI=1S/C21H22N2O4/c24-20(25)13-22-9-11-23(12-10-22)21(26)27-14-19-17-7-3-1-5-15(17)16-6-2-4-8-18(16)19/h1-8,19H,9-14H2,(H,24,25)
InChI Key	XNWPGFGLHGFRRP-UHFFFAOYSA-N
MDL Number	MFCD00270202
Molecular Formula	C21H22N2O4
Molecular Weight	366.4104
SMILES	O=C(O)CN1CCN(C(OCC2C3=C(C4=C2C=CC=C4)C=CC=C3)=O)CC1
Synonyms	180576-05-0, 2-(4-(((9H-Fluoren-9-yl)methoxy)carbonyl)piperazin-1-yl)acetic acid, Fmoc-(4-carboxymethyl)piperazine, AC1LJQP9, Fmoc-4-carboxymethylpiperazine, SCHEMBL119822, 4-Fmoc-1-piperazineacetic acid, CTK0H4169, DTXSID40359660, 2-[4-(9H-fluoren-9-ylmethoxycarbonyl)piperazin-1-yl]acetic Acid, ZINC4521500, ANW-74877, MFCD00270202, AKOS012614571, MCULE-6050266967, AJ-51420, Fmoc-4-carboxymethyl-piperazine, AldrichCPR, TC-163622, ST51016050, Z5697, J-011532, I14-40178, 1-Piperazineaceticacid, 4-[(9H-fluoren-9-ylmethoxy)carbonyl]-, 1-Piperazineaceticacid,4-[(9H-fluoren-9-ylmethoxy)carbonyl]-, 2-{4-[(fluoren-9-ylmethyl)oxycarbonyl]piperazinyl}acetic acid, (4-{[(9H-Fluoren-9-yl)methoxy]carbonyl}piperazin-1-yl)acetic acid, {4-[(9H-fluoren-9-ylmethoxy)carbonyl]piperazin-1-yl}acetic acid, 1-Piperazineacetic acid, 4-[(9H-fluoren-9-ylmethoxy)carbonyl]-, XNWPGFGLHGFRRP-UHFFFAOYSA-N, C21H22N2O4, 4-Fmoc-1-piperazineacetic acid hydrate, CID978353, B-7505,

Complexity	524
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	366.158g/mol
Formal Charge	0
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	366.417g/mol
Monoisotopic Mass	366.158g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	70.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 3077

Certificate of Analysis

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