AG0048C8

886768-17-8 | 1-Boc-3-(4-Methoxyphenyl)piperazine

AG0048C8

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CAS Number	886768-17-8
Catalog Number	AG0048C8(AGN-PC-0VN6B0)
Chemical Name	1-Boc-3-(4-Methoxyphenyl)piperazine
IUPAC Name	tert-butyl 3-(4-methoxyphenyl)piperazine-1-carboxylate
InChI	InChI=1S/C16H24N2O3/c1-16(2,3)21-15(19)18-10-9-17-14(11-18)12-5-7-13(20-4)8-6-12/h5-8,14,17H,9-11H2,1-4H3
InChI Key	CFWSKJOGTKJXPT-UHFFFAOYSA-N
MDL Number	MFCD06660434
Molecular Formula	C16H24N2O3
Molecular Weight	292.3734
SMILES	COC1=CC=C(C2NCCN(C(OC(C)(C)C)=O)C2)C=C1
Synonyms	886768-17-8, 1-BOC-3-(4-METHOXYPHENYL)PIPERAZINE, TERT-BUTYL 3-(4-METHOXYPHENYL)PIPERAZINE-1-CARBOXYLATE, SCHEMBL12520694, CTK5G1195, KS-00001OXU, DTXSID70587676, CFWSKJOGTKJXPT-UHFFFAOYSA-N, MFCD06660434, AKOS005257318, AB26731, GL-0426, MCULE-3440037019, 1-N-Boc-3-(4-methoxyphenyl)piperazine, AS-35474, DA-01796, FT-0083900, FT-0660092, X-2494, Z2785965913, 3-(4-methoxyphenyl)piperazine-1-carboxylic acid tert-butyl ester, 1-Piperazinecarboxylicacid, 3-(4-methoxyphenyl)-, 1,1-dimethylethyl ester, 3-(4-METHOXY-PHENYL)-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER, 3-(4-METHOXY-PHENYL)-PIPERAZINE-1-CARBOXYLICACIDTERT-BUTYLESTER, 3- -PIPERAZINE-1-CARBOXYLICACIDTERT-BUTYLESTER,

Complexity	346
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	292.179g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	292.379g/mol
Monoisotopic Mass	292.179g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	50.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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