AG00II7A

944742-29-4 | 5-Fluoro-7-methoxyquinazolin-4(3H)-one

AG00II7A

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CAS Number	944742-29-4
Catalog Number	AG00II7A(AGN-PC-0WAMJF)
Chemical Name	5-Fluoro-7-methoxyquinazolin-4(3H)-one
IUPAC Name	5-fluoro-7-methoxy-3H-quinazolin-4-one
InChI	InChI=1S/C9H7FN2O2/c1-14-5-2-6(10)8-7(3-5)11-4-12-9(8)13/h2-4H,1H3,(H,11,12,13)
InChI Key	VWAQAXQCMOLAKY-UHFFFAOYSA-N
MDL Number	MFCD13191851
Molecular Formula	C9H7FN2O2
Molecular Weight	194.1625
SMILES	O=C1NC=NC2=C1C(F)=CC(OC)=C2
Synonyms	5-fluoro-7-methoxyquinazolin-4(3H)-one, 944742-29-4, 4(3H)-Quinazolinone, 5-fluoro-7-methoxy-, SCHEMBL2798284, SCHEMBL15900305, VWAQAXQCMOLAKY-UHFFFAOYSA-N, 5-fluoro-7-methoxyquinazolin-4-ol, BCP18476, MFCD13191851, AKOS027338963, ZINC169241558, 5-fluoro-7-methoxy-4(3H)-Quinazolinone, AK341443, DS-12275, CS-0038611, ACN-036969,

Complexity	270
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	194.049g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	194.165g/mol
Monoisotopic Mass	194.049g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

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

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