AG000LOZ

1242156-53-1 | 1(2H)-Isoquinolinone, 6-cyclopropyl-8-fluoro-

AG000LOZ

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CAS Number	1242156-53-1
Catalog Number	AG000LOZ(AGN-PC-0WCXMO)
Chemical Name	1(2H)-Isoquinolinone, 6-cyclopropyl-8-fluoro-
IUPAC Name	6-cyclopropyl-8-fluoro-2H-isoquinolin-1-one
InChI	InChI=1S/C12H10FNO/c13-10-6-9(7-1-2-7)5-8-3-4-14-12(15)11(8)10/h3-7H,1-2H2,(H,14,15)
InChI Key	LDOIRSRUYDIUTP-UHFFFAOYSA-N
MDL Number	MFCD22572858
Molecular Formula	C12H10FNO
Molecular Weight	203.2123
SMILES	FC1=C2C(C=CNC2=O)=CC(C2CC2)=C1
Synonyms	6-cyclopropyl-8-fluoroisoquinolin-1(2H)-one, 1242156-53-1, 6-cyclopropyl-8-fluoro-1,2-dihydroisoquinolin-1-one, SCHEMBL1725900, SCHEMBL16763553, LDOIRSRUYDIUTP-UHFFFAOYSA-N, CS-M3144, KS-00001F3W, MFCD22572858, ZINC116943471, 6-cyclopropyl-8-fluoroisoquinolin-1-ol, AK173692, AS-43436, 6-cyclopropyl-8-fluoro-2H-isoquinolin-1-one, 1(2H)-Isoquinolinone,6-cyclopropyl-8-fluoro-, 6-cyclopropyl-8-fluoroisoquinolin-1 (2H)-one, EN300-200904, 1(2H)-Isoquinolinone, 6-cyclopropyl-8-fluoro-,

Complexity	311
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	203.075g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	203.216g/mol
Monoisotopic Mass	203.075g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	29.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H320-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number