AG008Z18

1057217-63-6 | 7-Bromoquinoline-2-carboxylic acid

AG008Z18

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CAS Number	1057217-63-6
Catalog Number	AG008Z18(AGN-PC-05OZPY)
Chemical Name	7-Bromoquinoline-2-carboxylic acid
IUPAC Name	7-bromoquinoline-2-carboxylic acid
InChI	InChI=1S/C10H6BrNO2/c11-7-3-1-6-2-4-8(10(13)14)12-9(6)5-7/h1-5H,(H,13,14)
InChI Key	PLRDUYBIGUGOKD-UHFFFAOYSA-N
MDL Number	MFCD11108693
Molecular Formula	C10H6BrNO2
Molecular Weight	252.0641
SMILES	O=C(C1=NC2=CC(Br)=CC=C2C=C1)O
Synonyms	7-Bromoquinoline-2-carboxylic acid, 1057217-63-6, AK-76417, SCHEMBL3365551, CTK8B5595, DTXSID60652867, PLRDUYBIGUGOKD-UHFFFAOYSA-N, 7-Bromo-2-quinolinecarboxylic acid, KS-00000PG7, ANW-49246, MFCD11108693, ZINC26474823, AKOS015920292, CS-W008858, DS-1408, FCH1402470, AJ-82445, BR-76417, 7-Bromoquinoline-2-carboxylic acid, 96%, AB0034596, AX8222173, TC-137991, 4CH-011137, ST24024499, X8774, S-7125, C10H6BrNO2, 7-Bromoquinoline-2-carboxylicacid,

Complexity	234
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	250.958g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	252.067g/mol
Monoisotopic Mass	250.958g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number