AG003MAL

448193-94-0 | 5,7-DICHLORO-2,3-DIHYDRO-1H-INDEN-1-ONE

AG003MAL

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CAS Number	448193-94-0
Catalog Number	AG003MAL(AGN-PC-03NGFY)
Chemical Name	5,7-DICHLORO-2,3-DIHYDRO-1H-INDEN-1-ONE
IUPAC Name	5,7-dichloro-2,3-dihydroinden-1-one
InChI	InChI=1S/C9H6Cl2O/c10-6-3-5-1-2-8(12)9(5)7(11)4-6/h3-4H,1-2H2
InChI Key	TWNXYJNWNZZECV-UHFFFAOYSA-N
MDL Number	MFCD09908160
Molecular Formula	C9H6Cl2O
Molecular Weight	201.0493
SMILES	ClC1=CC(Cl)=C2C(=O)CCC2=C1
Synonyms	448193-94-0, 5,7-Dichloro-2,3-dihydro-1H-inden-1-one, 5,7-DICHLORO-1-INDANONE, 5,7-Dichloro-2,3-dihydroinden-1-one, 1H-Inden-1-one, 5,7-dichloro-2,3-dihydro-, 5,7-Dichloroindan-1-one, MFCD09908160, ACMC-1ASF2, SCHEMBL321243, CTK4I8475, DTXSID40624466, TWNXYJNWNZZECV-UHFFFAOYSA-N, 5,7-Dichloro-1-indanone, 97%, 6181AB, ANW-68258, ZINC35570376, AKOS010641469, CD-1870, MCULE-8251784565, NE48833, AJ-91586, SC-11797, RT-010003, ST24044102, I14-16758, Z1436473078, C9H6Cl2O, ACN-030639,

Complexity	205
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	199.98g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	201.046g/mol
Monoisotopic Mass	199.98g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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