AG007F8Y

33491-30-4 | 8-Bromo-2H-1-Benzopyran-2-One

AG007F8Y

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CAS Number	33491-30-4
Catalog Number	AG007F8Y(AGN-PC-0NGVSH)
Chemical Name	8-Bromo-2H-1-Benzopyran-2-One
IUPAC Name	8-bromochromen-2-one
InChI	InChI=1S/C9H5BrO2/c10-7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5H
InChI Key	BIVMXYHSBRLPDE-UHFFFAOYSA-N
MDL Number	MFCD09999238
Molecular Formula	C9H5BrO2
Molecular Weight	225.0388
SMILES	BrC1=CC=CC2=C1OC(C=C2)=O
Synonyms	8-BROMO-2H-1-BENZOPYRAN-2-ONE, 33491-30-4, 8-bromo-2H-chromen-2-one, 8-bromochromen-2-one, 8-bromocoumarin, SCHEMBL3282340, CTK8B5854, KS-00000HHW, DTXSID80457275, BIVMXYHSBRLPDE-UHFFFAOYSA-N, ANW-50584, MFCD09999238, ZINC38313360, AKOS015835867, DS-0386, RP27551, AJ-95014, AK-24668, BR-24668, CJ-19206, AB0024278, ST2412593, TR-014011, 4CH-008118, AM20040199, FT-0646130, W5516, S-6778, J-519382, C9H5BrO2, CID11160450,

Complexity	225
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	223.947g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	225.041g/mol
Monoisotopic Mass	223.947g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number