AG00EFTZ

59280-69-2 | 3-Bromo-4-methylquinoline

AG00EFTZ

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CAS Number	59280-69-2
Catalog Number	AG00EFTZ(AGN-PC-0NIAQ4)
Chemical Name	3-Bromo-4-methylquinoline
IUPAC Name	3-bromo-4-methylquinoline
InChI	InChI=1S/C10H8BrN/c1-7-8-4-2-3-5-10(8)12-6-9(7)11/h2-6H,1H3
InChI Key	ACHKGDKYEZFMQD-UHFFFAOYSA-N
MDL Number	MFCD08705664
Molecular Formula	C10H8BrN
Molecular Weight	222.0812
SMILES	CC1=C(Br)C=NC2=CC=CC=C12
Synonyms	3-BROMO-4-METHYLQUINOLINE, 59280-69-2, Quinoline, 3-bromo-4-methyl-, AK126205, SCHEMBL5517493, CHEMBL1889528, CTK5A9701, DTXSID20483199, MFCD08705664, ZINC14982283, AKOS016013125, DS-5078, FCH1389749, SB21329, NCGC00188280-01, AJ-65622, SC-51167, AX8085105, DB-081678, FT-0722748,

Complexity	160
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	220.984g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	222.085g/mol
Monoisotopic Mass	220.984g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	12.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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