AG0034E3

194851-16-6 | 7-bromoquinazolin-4(3H)-one

AG0034E3

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CAS Number	194851-16-6
Catalog Number	AG0034E3(AGN-PC-00VZ6O)
Chemical Name	7-bromoquinazolin-4(3H)-one
IUPAC Name	7-bromo-3H-quinazolin-4-one
InChI	InChI=1S/C8H5BrN2O/c9-5-1-2-6-7(3-5)10-4-11-8(6)12/h1-4H,(H,10,11,12)
InChI Key	FUGKKMYSCAYXJJ-UHFFFAOYSA-N
MDL Number	MFCD02721511
Molecular Formula	C8H5BrN2O
Molecular Weight	225.0421
SMILES	BrC1=CC=C2C(NC=NC2=C1)=O
Synonyms	194851-16-6, 7-Bromoquinazolin-4(3H)-one, 7-Bromo-3,4-dihydroquinazolin-4-one, 7-Bromoquinazolin-4-ol, 7-bromo-1H-quinazolin-4-one, 7-bromoquinazolin-4(1H)-one, 7-bromo-3H-quinazolin-4-one, 4(1H)-Quinazolinone, 7-bromo-, 7-BROMO-4(3H)-QUINAZOLINONE, PubChem14643, ACMC-209eym, 7-bromo-4-quinazolinone, ACMC-209z6z, SCHEMBL391295, 4(3H)-Quinazolinone,7-bromo-, SCHEMBL12489082, 7-bromanyl-1H-quinazolin-4-one, CTK4E1635, 7-bromo-3-hydroquinazolin-4-one, DTXSID60585843, FUGKKMYSCAYXJJ-UHFFFAOYSA-N, BCP08954, ZINC7738290, ANW-23660, ANW-49881, MFCD07838323, SBB054685, AKOS015918029, AKOS017344953, AKOS028109887, 7-Bromo-3,4-dihydroquinazoline-4-one, CB-2708, CS-W008741, FS-2622, PB29464, QC-6148, RP27562, VZ30890, 4(3H)-QUINAZOLINONE, 7-BROMO-, AJ-57219, AK-24274, AM803452, AN-30217, BC003892, BR-24274, CJ-13151, SC-44405, SY034758, 7-bromoquinazolin-4(3H)-one, AldrichCPR, AB0023157, AB1010317, DB-029354, TC-112405, 4CH-005767, FT-0648465, W4158, EN300-23520, MFCD07838323 (97%), A18388, C-8763, 194B166, 851B166, A813759, I14-8690, J-519125, 7-Bromoquinazolin-4-one, C8H5BrN2O, ACN-028616, 7-Bromo-3,4-dihydroquinazolin-4-one, 97% 1g,

Complexity	229
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	223.959g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	225.045g/mol
Monoisotopic Mass	223.959g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	41.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number