AG000ML7

1246765-38-7 | 2(1H)-Quinazolinone, 6-bromo-3,4-dihydro-

AG000ML7

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CAS Number	1246765-38-7
Catalog Number	AG000ML7(AGN-PC-0WABTP)
Chemical Name	2(1H)-Quinazolinone, 6-bromo-3,4-dihydro-
IUPAC Name	6-bromo-3,4-dihydro-1H-quinazolin-2-one
InChI	InChI=1S/C8H7BrN2O/c9-6-1-2-7-5(3-6)4-10-8(12)11-7/h1-3H,4H2,(H2,10,11,12)
InChI Key	LPMQSNAFKKEZAK-UHFFFAOYSA-N
MDL Number	MFCD13180559
Molecular Formula	C8H7BrN2O
Molecular Weight	227.0580
SMILES	O=C1NC2=C(C=C(Br)C=C2)CN1
Synonyms	6-Bromo-3,4-dihydroquinazolin-2(1H)-one, 1246765-38-7, AK-42603, 6-bromo-3,4-dihydro-1H-quinazolin-2-one, SCHEMBL429197, DTXSID30735570, LPMQSNAFKKEZAK-UHFFFAOYSA-N, KS-00000OI2, 3456AJ, MFCD13180559, ZINC84325010, AKOS022173381, FCH1380355, DS-14086, AJ-126282, AX8209934, ST2412221, 4CH-016329, 2(1H)-Quinazolinone, 6-bromo-3,4-dihydro-, C8H7BrN2O, 6-Bromo-3,4-dihydroquizolin-2(1H)-one,

Complexity	198
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	225.974g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	227.061g/mol
Monoisotopic Mass	225.974g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	41.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

Lot Number