AG003N6C

3260-78-4 | 6-Chloro-3-benzofuranone

AG003N6C

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CAS Number	3260-78-4
Catalog Number	AG003N6C(AGN-PC-0WABX5)
Chemical Name	6-Chloro-3-benzofuranone
IUPAC Name	6-chloro-1-benzofuran-3-one
InChI	InChI=1S/C8H5ClO2/c9-5-1-2-6-7(10)4-11-8(6)3-5/h1-3H,4H2
InChI Key	QSYZLDHZMYWEKL-UHFFFAOYSA-N
MDL Number	MFCD06738725
Molecular Formula	C8H5ClO2
Molecular Weight	168.5771
SMILES	O=C1COC2=CC(Cl)=CC=C12
Synonyms	3260-78-4, 6-Chloro-3-Benzofuranone, 6-Chlorobenzofuran-3(2H)-one, 6-CHLORO-BENZOFURAN-3-ONE, 6-CHLORO-2,3-DIHYDRO-1-BENZOFURAN-3-ONE, 6-Chlorobenzo[b]furan-3(2H)-one, PubChem17377, 6-Chlorobenzofuran-3-one, SCHEMBL568794, 6-chloro-1-benzofuran-3-one, AMOT0721, 6-chloranyl-1-benzofuran-3-one, 6-chloro-benzofuran-3(2h)-one, CTK1C2246, DTXSID20549148, QSYZLDHZMYWEKL-UHFFFAOYSA-N, 6-chloro-benzofuran-3 (2h)-one, ACT08889, BCP11607, 6-Chloro-1-benzofuran-3(2H)-one, ANW-46154, MFCD06738725, SBB068519, ZINC36533494, AKOS006293138, 6-Chloro-2,3-dihydrobenzofuran-3-one, AB27747, AS06461, CM10772, FS-3487, MP-0018, RP23115, TRA0070489, AJ-93204, AK-25773, BC681113, SC-20789, SY009720, 6-Chloro-2,3-dihydrobenzo[b]furan-3-one, AB0024215, TC-134899, 4CH-000539, FT-0648015, ST24024338, W5440, MFCD06738725 (97%), 260C784, A830185, I14-7286, J-019965, J-518545, Z1741979328, 5-Bromo-benzofuran-3-one, 6-Bromo-3-Benzofuranone, C8H5ClO2, cc-577, 6-chloro-2-hydrobenzo[b]furan-3-one, 6-CHLORO-3(2H)-BENZOFURANONE, 3(2H)-BENZOFURANONE, 6-CHLORO-, ACN-041109, 351528-80-8, 54450-20-3,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	167.998g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	168.576g/mol
Monoisotopic Mass	167.998g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number