AG00BYVU

374930-88-8 | 5-BROMO-2-(4-BOC-PIPERAZIN-1-YL)PYRIMIDINE

AG00BYVU

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CAS Number	374930-88-8
Catalog Number	AG00BYVU(AGN-PC-03HND4)
Chemical Name	5-BROMO-2-(4-BOC-PIPERAZIN-1-YL)PYRIMIDINE
IUPAC Name	tert-butyl 4-(5-bromopyrimidin-2-yl)piperazine-1-carboxylate
InChI	InChI=1S/C13H19BrN4O2/c1-13(2,3)20-12(19)18-6-4-17(5-7-18)11-15-8-10(14)9-16-11/h8-9H,4-7H2,1-3H3
InChI Key	UKCBGXCNXOKVTF-UHFFFAOYSA-N
MDL Number	MFCD07375175
Molecular Formula	C13H19BrN4O2
Molecular Weight	343.2196
SMILES	O=C(N1CCN(C2=NC=C(Br)C=N2)CC1)OC(C)(C)C
Synonyms	374930-88-8, 5-BROMO-2-(4-BOC-PIPERAZIN-1-YL)PYRIMIDINE, tert-butyl 4-(5-bromopyrimidin-2-yl)piperazine-1-carboxylate, 1-boc-4-(5-bromopyrimidin-2-yl)piperazine, 1-N-Boc-4-(5-Bromopyrimidin-2-yl)piperazine, 4-(5-Bromopyrimidin-2-yl)piperazine-1-carboxylic acid tert-butyl ester, ACMC-209ite, C13H19BrN4O2, SCHEMBL712231, CTK4H8303, DTXSID60620006, UKCBGXCNXOKVTF-UHFFFAOYSA-N, ALBB-027793, KS-00000K3D, ZINC8698505, ANW-28656, MFCD07375175, AKOS013100003, AB41360, RTR-015214, AJ-58126, AK-22023, AM803807, BR-22023, CJ-13445, DS-10283, SY064515, AB0024543, DB-001614, ST2419958, TR-015214, 5-Bromo-2-(4-Boc-1-piperazinyl)pyrimidine, FT-0653790, W5836, MFCD07375175 (95%), A-2325, B67408, A823698, I14-3845, 1-tert-Butoxycarbonyl-4-(5-bromopyrimidin-2-yl)piperazine, 5-Bromo-2-(4-boc-piperazin-1-yl)pyrimidine, AldrichCPR, 5-Bromo-2-(4-tert-butoxycarbonyl-piperazin-1-yl)pyrimidine, 1,1-dimethylethyl 4-(5-bromo-2-pyrimidinyl)-1-piperazinecarboxylate, 1-dimethylethyl 4-(5-bromo-2-pyrimidinyl)-1-piperazinecarboxylate, tert-butyl 4-(5-bromanylpyrimidin-2-yl)piperazine-1-carboxylate, 4-(5-bromo-2-pyrimidinyl)-1-piperazinecarboxylic acid tert-butyl ester, 4-(5-Bromo-pyrimidin-2-yl)-piperazine-1-carboxylic acid tert-butyl ester, 4-(5-bromopyrimidin-2-yl) piperazine-1-carboxylic acid tert-butyl ester, 4-(5-Bromopyrimidin-2yl)piperazine-1-carboxylic acid tert-butyl ester, 4-(5-Bromopyrirnidin-2-yl)piperazine-1-carboxylic acid tert-butyl ester, 1-piperazinecarboxylic acid, 4-(5-bromo-2-pyrimidinyl)-, 1,1-dimethylethyl ester, 1-Piperazinecarboxylicacid, 4-(5-bromo-2-pyrimidinyl)-, 1,1-dimethylethyl ester, ACN-050658, 4-(5-Bromopyrimidin-2-yl)piperazine-1-carboxylic acid. tert-butyl ester,

Complexity	332
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	342.069g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	343.225g/mol
Monoisotopic Mass	342.069g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	58.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H317-H319
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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