AG00FGHJ

7114-80-9 | 3-Methylisoquinolin-1(2H)-one

AG00FGHJ

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	7114-80-9
Catalog Number	AG00FGHJ(AGN-PC-0KR3ID)
Chemical Name	3-Methylisoquinolin-1(2H)-one
IUPAC Name	3-methyl-2H-isoquinolin-1-one
InChI	InChI=1S/C10H9NO/c1-7-6-8-4-2-3-5-9(8)10(12)11-7/h2-6H,1H3,(H,11,12)
InChI Key	QAOMZDFCQJQQQS-UHFFFAOYSA-N
MDL Number	MFCD03447190
Molecular Formula	C10H9NO
Molecular Weight	159.1846
SMILES	O=c1c2c(cc([nH]1)C)cccc2
Synonyms	3-methylisoquinolin-1(2H)-one, 7114-80-9, 3-methyl-2H-isoquinolin-1-one, 3-methylisoquinolin-1-ol, 3-methyl-1,2-dihydroisoquinolin-1-one, 3-METHYL-1(2H)-ISOQUINOLINONE, MLS000089833, methylisocarbostyril, 3-methyl-1-isoquinolinol, 3-methyl-isoquinolin-1-ol, AC1MMU60, SCHEMBL161637, 1-hydroxy-3-methylisoquinoline, CHEMBL1328779, CTK2H3995, 3-Methylisoquinoline-1(2H)-one, DTXSID70390546, QAOMZDFCQJQQQS-UHFFFAOYSA-N, HMS2478I16, 1(2H)-Isoquinolinone, 3-methyl-, ZINC8670097, 2357AJ, MFCD03447190, AKOS006279198, AKOS022635913, CM10269, MB02879, MCULE-2561349456, AJ-57864, AS-47401, SMR000024451, 4CH-002847, EU-0008838, Z-5874, AG-777/40171120, SR-01000468868, SR-01000468868-1, I14-59057, F0919-1103, C10H9NO, 3-METHYLISOQUINOLIN-1 -ONE, CID3244477,

Complexity	232
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	159.068g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	159.188g/mol
Monoisotopic Mass	159.068g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	29.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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