AG01C5D2

881190-95-0 | 7-Chloro-6-fluoro-2,3-dihydro-1H-inden-1-one

AG01C5D2

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CAS Number	881190-95-0
Catalog Number	AG01C5D2(AGN-PC-0IE2B4)
Chemical Name	7-Chloro-6-fluoro-2,3-dihydro-1H-inden-1-one
IUPAC Name	7-chloro-6-fluoro-2,3-dihydroinden-1-one
InChI	InChI=1S/C9H6ClFO/c10-9-6(11)3-1-5-2-4-7(12)8(5)9/h1,3H,2,4H2
InChI Key	STNPXHSEDNMJFC-UHFFFAOYSA-N
MDL Number	MFCD16038683
Molecular Formula	C9H6ClFO
Molecular Weight	184.5947
SMILES	O=C1CCC2=C1C(Cl)=C(F)C=C2
Synonyms	7-chloro-6-fluoro-2,3-dihydro-1H-Inden-1-one, 881190-95-0, 1H-Inden-1-one, 7-chloro-6-fluoro-2,3-dihydro-, 7-chloro-6-fluoro-1-indanone, SCHEMBL5200099, AKOS030527133, ZINC143915543, DB-077192, FT-0734007,

Complexity	207
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	184.009g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	184.594g/mol
Monoisotopic Mass	184.009g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
UN Code

Certificate of Analysis

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