AG003A7X

52605-98-8 | 5-Bromo-2,3-dimethoxypyridine

AG003A7X

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CAS Number	52605-98-8
Catalog Number	AG003A7X(AGN-PC-0NJEZA)
Chemical Name	5-Bromo-2,3-dimethoxypyridine
IUPAC Name	5-bromo-2,3-dimethoxypyridine
InChI	InChI=1S/C7H8BrNO2/c1-10-6-3-5(8)4-9-7(6)11-2/h3-4H,1-2H3
InChI Key	VSXDRIVAPWWONE-UHFFFAOYSA-N
MDL Number	MFCD11052853
Molecular Formula	C7H8BrNO2
Molecular Weight	218.0479
SMILES	COC1=CC(Br)=CN=C1OC
Synonyms	5-Bromo-2,3-dimethoxypyridine, 52605-98-8, Pyridine, 5-bromo-2,3-dimethoxy-, AK-82785, ACMC-209l0m, SCHEMBL8916, 5-Bromo-2,3-dimethoxy-pyridine, CTK6J5117, DTXSID90502664, VSXDRIVAPWWONE-UHFFFAOYSA-N, 5-bromanyl-2,3-dimethoxy-pyridine, AC1Q4857, ANW-31508, MFCD11052853, ZINC35270323, AKOS015834226, FCH1402140, RL03936, VP11284, KS-00000J68, AJ-91115, CJ-18702, DS-16924, 5-Bromo-2,3-dimethoxypyridine, AldrichCPR, AB0042769, AX8196616, TR-018659, FT-0678838, ST24044389, Z0659, A-6504, A829170, I02-3998, I03-0372, J-516872, C7H8BrNO2, 2,3-dimethoxy 5-bromo pyridine,

Complexity	123
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	216.974g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	218.05g/mol
Monoisotopic Mass	216.974g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	31.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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