AG007ZK2

1355174-78-5 | Methyl 5-bromoquinoline-2-carboxylate

AG007ZK2

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CAS Number	1355174-78-5
Catalog Number	AG007ZK2(AGN-PC-0BL85B)
Chemical Name	Methyl 5-bromoquinoline-2-carboxylate
IUPAC Name	methyl 5-bromoquinoline-2-carboxylate
InChI	InChI=1S/C11H8BrNO2/c1-15-11(14)10-6-5-7-8(12)3-2-4-9(7)13-10/h2-6H,1H3
InChI Key	CWPHCBOAHXYHJF-UHFFFAOYSA-N
MDL Number	MFCD21086458
Molecular Formula	C11H8BrNO2
Molecular Weight	266.0907
SMILES	O=C(C1=NC2=CC=CC(Br)=C2C=C1)OC
Synonyms	Methyl 5-bromoquinoline-2-carboxylate, 1355174-78-5, AK-76595, SCHEMBL20604750, CTK8B5594, DTXSID90719255, KS-00000PH4, ANW-49244, MFCD21086458, ZINC72187496, AKOS015920236, BR-76595, CJ-21649, DS-16722, AB0035550, AJ-119112, AX8222622, TC-137989, 4CH-011166, ST24025421, X9920, S-7237, C11H8BrNO2, Methyl5-bromoquinoline-2-carboxylate,

Complexity	247
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	264.974g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	266.094g/mol
Monoisotopic Mass	264.974g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

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