AG000IID

1192815-02-3 | 3-Isoquinolinamine, 7-bromo-

AG000IID

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CAS Number	1192815-02-3
Catalog Number	AG000IID(AGN-PC-09MQSM)
Chemical Name	3-Isoquinolinamine, 7-bromo-
IUPAC Name	7-bromoisoquinolin-3-amine
InChI	InChI=1S/C9H7BrN2/c10-8-2-1-6-4-9(11)12-5-7(6)3-8/h1-5H,(H2,11,12)
InChI Key	FBTKUAFGTDENLW-UHFFFAOYSA-N
MDL Number	MFCD11040207
Molecular Formula	C9H7BrN2
Molecular Weight	223.0693
SMILES	BrC1=CC=C2C(=C1)C=NC(=C2)N
Synonyms	7-BROMOISOQUINOLIN-3-AMINE, 1192815-02-3, 7-Bromoisoquinolin-3(2H)-imine, 7-BROMO-3-ISOQUINOLINAMINE, AK-24946, 7-bromo-isoquinolin-3-amine, SCHEMBL558012, 3-Isoquinolinamine, 7-bromo-, CTK4B1206, KS-00000HQQ, DTXSID70680959, FBTKUAFGTDENLW-UHFFFAOYSA-N, 3-AMINO-7-BROMOISOQUINOLINE, ZX-AT001733, ANW-49434, MFCD11040207, ZINC64033574, AKOS015835874, CS-W008861, FCH1401516, FS-1011, PB25313, QC-8119, RP27445, BR-24946, CJ-20970, OR301335, SC-26509, AB0035100, AJ-114625, AX8160381, AX8298566, DB-061549, TR-034354, 4CH-008592, AM20050705, FT-0688249, ST24029911, X9374, S-7443, J-519167, C9H7BrN2, 7-bromoisoquinolin-3-amine, 95% - 1G 1g, N/A,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.979g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	223.073g/mol
Monoisotopic Mass	221.979g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	38.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number