AG00I8BO

434319-41-2 | Ethyl 3-Bromopyridine-2-carboxylate

AG00I8BO

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CAS Number	434319-41-2
Catalog Number	AG00I8BO(AGN-PC-003XA2)
Chemical Name	Ethyl 3-Bromopyridine-2-carboxylate
IUPAC Name	ethyl 3-bromopyridine-2-carboxylate
InChI	InChI=1S/C8H8BrNO2/c1-2-12-8(11)7-6(9)4-3-5-10-7/h3-5H,2H2,1H3
InChI Key	FQVBRIVSBFQMQA-UHFFFAOYSA-N
MDL Number	MFCD13189685
Molecular Formula	C8H8BrNO2
Molecular Weight	230.0586
SMILES	O=C(OCC)C1=NC=CC=C1Br
Synonyms	Ethyl 3-bromopicolinate, 434319-41-2, ETHYL 3-BROMOPYRIDINE-2-CARBOXYLATE, SCHEMBL6759202, KS-00000BSW, DTXSID60568954, FQVBRIVSBFQMQA-UHFFFAOYSA-N, Ethyl3-Bromopyridine-2-carboxylate, 6006AB, MFCD13189685, ZINC34477193, AKOS016000977, AB68905, DS-5877, AJ-88788, AK128513, bromo pyridine carboxylic acid ethyl ester, SY025917, CS-0041849, MFCD13189685 (95%), 2-PYRIDINECARBOXYLIC ACID, 3-BROMO-, ETHYL ESTER, Ethyl3-bromopicolinate, C8H8BrNO2,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	228.974g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	230.061g/mol
Monoisotopic Mass	228.974g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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