AG008Z4U

1060814-91-6 | Ethyl 2-(4-bromopyridin-2-yl)acetate

AG008Z4U

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CAS Number	1060814-91-6
Catalog Number	AG008Z4U(AGN-PC-0WNNM4)
Chemical Name	Ethyl 2-(4-bromopyridin-2-yl)acetate
IUPAC Name	ethyl 2-(4-bromopyridin-2-yl)acetate
InChI	InChI=1S/C9H10BrNO2/c1-2-13-9(12)6-8-5-7(10)3-4-11-8/h3-5H,2,6H2,1H3
InChI Key	UNQUMGSSWNEUIM-UHFFFAOYSA-N
MDL Number	MFCD10566271
Molecular Formula	C9H10BrNO2
Molecular Weight	244.0852
SMILES	BrC1=CC(=NC=C1)CC(=O)OCC
Synonyms	ETHYL 2-(4-BROMOPYRIDIN-2-YL)ACETATE, 1060814-91-6, AK398873, (4-BROMO-PYRIDIN-2-YL)-ACETIC ACID ETHYL ESTER, SCHEMBL9952026, UNQUMGSSWNEUIM-UHFFFAOYSA-N, MFCD10566271, ZINC95642080, Ethyl 2-(4-Bromo-2-pyridyl)acetate, AKOS026741235, AB56161, CS-W020454, NE56043, DS-14509, SC-13227, AX8216293, FT-0696793, EN300-170907,

Complexity	175
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	242.989g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	244.088g/mol
Monoisotopic Mass	242.989g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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