AG00C0Y5

374554-54-8 | 5-Amino-1-chloroisoquinoline

AG00C0Y5

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CAS Number	374554-54-8
Catalog Number	AG00C0Y5(AGN-PC-0JRHJN)
Chemical Name	5-Amino-1-chloroisoquinoline
IUPAC Name	1-chloroisoquinolin-5-amine
InChI	InChI=1S/C9H7ClN2/c10-9-7-2-1-3-8(11)6(7)4-5-12-9/h1-5H,11H2
InChI Key	DDELEGMETMZLAF-UHFFFAOYSA-N
MDL Number	MFCD09258640
Molecular Formula	C9H7ClN2
Molecular Weight	178.6183
SMILES	NC1=CC=CC2=C1C=CN=C2Cl
Synonyms	5-Amino-1-chloroisoquinoline, 374554-54-8, 1-chloroisoquinolin-5-amine, MFCD09258640, PubChem6280, ACMC-1ADAN, AC1LA16O, 1-chloro-5-isoquinolinamine, 1-chloro-5-isoquinolylamine, 1-chloro-5-aminoisoquinoline, 5-Isoquinolinamine,1-chloro-, 1-chloranylisoquinolin-5-amine, 5-Isoquinolinamine, 1-chloro-, SCHEMBL2380637, CTK4H8192, KS-00002AGW, DTXSID20332698, DDELEGMETMZLAF-UHFFFAOYSA-N, BCP11497, ZINC5933742, ANW-28644, SBB070230, AKOS005257226, PS-5639, QC-3403, RP23997, RTR-015195, AJ-55236, AN-28644, CJ-12800, AB0038060, TR-015195, 4CH-021854, FT-0652446, ST24044308, Y5407, 554A548, A823665, J-516652, 1-2 weeks, C9H7ClN2, 5-amine-1-chloroisoquinolin, AIDS020738, CID459771, (2-methoxycarbonylphenyl)boronic Acid, 5-Isoquinolinamine, 1-chloro- (9CI), ACN-030451, 2-CARBOMETHOXYBENZENEBORONIC ACID,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.03g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	178.619g/mol
Monoisotopic Mass	178.03g/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
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number