AG00BCYM

25475-67-6 | 3-Isoquinolinamine

AG00BCYM

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CAS Number	25475-67-6
Catalog Number	AG00BCYM(AGN-PC-0JOTAP)
Chemical Name	3-Isoquinolinamine
IUPAC Name	isoquinolin-3-amine
InChI	InChI=1S/C9H8N2/c10-9-5-7-3-1-2-4-8(7)6-11-9/h1-6H,(H2,10,11)
InChI Key	VYCKDIRCVDCQAE-UHFFFAOYSA-N
MDL Number	MFCD00102190
Molecular Formula	C9H8N2
Molecular Weight	144.1732
NSC Number	218383
SMILES	Nc1ncc2c(c1)cccc2
Synonyms	isoquinolin-3-amine, 3-Aminoisoquinoline, 25475-67-6, 3-Isoquinolinamine, Isoquinolin-3-ylamine, Isoquinoline, 3-amino-, Isoquinoline-3-amine, CHEMBL61743, VYCKDIRCVDCQAE-UHFFFAOYSA-N, AK-27774, W-202073, 3-isoquinolylamine, isoquinolin-3-imine, NSC218383, zlchem 309, PubChem6217, isoquinoline-3-ylamine, uPa_46, 3-Aminoisoquinoline, 97%, AC1L7K3R, SCHEMBL177520, AC1Q52G5, 3-aminoisoquinoline, AldrichCPR, CTK1A3054, CTK4C1857, ZLC0134, WT720, ZINC157801, ACT01923, ZX-AT005053, ANW-50449, BBL101046, BDBM50091818, CA-845, FCH918628, MFCD00102190, SBB051996, STL554840, 25475-67-6 isoquinolin-3-amine, AKOS005256578, AB03416, CS-W009009, LS20125, NSC-218383, OR22000, PS-4190, QC-9358, RP01412, SDCCGMLS-0065877.P001, TRA0058952, VQ10150, ACM25475676, KS-00002A44, AC-26693, AN-25108, BR-27774, CC-14200, SC-02915, AB0005934, AX8007572, DB-011136, ST2413162, TC-063368, TL8002068, 4CH-015203, A5134, AM20051003, C2373, FT-0083824, FT-0627505, S-2565, 71442-EP2295432A1, 71442-EP2308833A2, 475I676, C-02319, I08-0079, InChI=1/C9H8N2/c10-9-5-7-3-1-2-4-8(7)6-11-9/h1-6H,(H2,10,11, Nc1ncc2ccccc2c1, C9H8N2, 3(2H)-ISOQUINOLINIMINE, 3(2H)-Isoquinolinimine (9CI), CID311869, ACN-030079, R163, 139557-81-6,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	144.069g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	144.177g/mol
Monoisotopic Mass	144.069g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	38.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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

Lot Number