AG0036IE

74124-90-6 | 4-Chloro-2-Indanone

AG0036IE

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CAS Number	74124-90-6
Catalog Number	AG0036IE(AGN-PC-02LB9Y)
Chemical Name	4-Chloro-2-Indanone
IUPAC Name	4-chloro-1,3-dihydroinden-2-one
InChI	InChI=1S/C9H7ClO/c10-9-3-1-2-6-4-7(11)5-8(6)9/h1-3H,4-5H2
InChI Key	OTJSQABZKAMVSX-UHFFFAOYSA-N
MDL Number	MFCD09744094
Molecular Formula	C9H7ClO
Molecular Weight	166.6043
SMILES	O=C1Cc2c(C1)cccc2Cl
Synonyms	4-Chloro-1H-inden-2(3H)-one, 74124-90-6, 4-Chloro-2-Indanone, 4-chloro-1,3-dihydro-2H-inden-2-one, 4-chloro-2,3-dihydro-1H-inden-2-one, AK113491, PubChem18014, 2H-Inden-2-one, 4-chloro-1,3-dihydro-, SCHEMBL9672282, CTK5D9385, DTXSID70600874, 4-chloro-1,3-dihydroinden-2-one, KS-00000O1H, CC-557, FCH869425, MFCD09744094, ZINC49588552, 4-chloranyl-1,3-dihydroinden-2-one, AKOS006329810, ACN-030566, FS-3752, MP-1611, 2H-Inden-2-one,4-chloro-1,3-dihydro-, CJ-20629, SC-85985, AB0063789, AJ-111354, AX8095749, ST2418241, TX-016974, 4CH-015877, FT-0657977, Z5087, A838024, I14-7313, C9H7ClO,

Complexity	178
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	166.019g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	166.604g/mol
Monoisotopic Mass	166.019g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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