AG000UDC

130408-16-1 | 1H-Inden-1-one, 4,7-difluoro-2,3-dihydro-

AG000UDC

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CAS Number	130408-16-1
Catalog Number	AG000UDC(AGN-PC-0JTD1H)
Chemical Name	1H-Inden-1-one, 4,7-difluoro-2,3-dihydro-
IUPAC Name	4,7-difluoro-2,3-dihydroinden-1-one
InChI	InChI=1S/C9H6F2O/c10-6-2-3-7(11)9-5(6)1-4-8(9)12/h2-3H,1,4H2
InChI Key	KMWBFTTYYGUTNW-UHFFFAOYSA-N
MDL Number	MFCD07772126
Molecular Formula	C9H6F2O
Molecular Weight	168.1401
SMILES	O=C1CCC2=C1C(F)=CC=C2F
Synonyms	4,7-DIFLUOROINDAN-1-ONE, 130408-16-1, 4,7-Difluoro-1-indanone, 4,7-difluoro-2,3-dihydro-1H-inden-1-one, 1H-Inden-1-one, 4,7-difluoro-2,3-dihydro-, AC1LBRPT, 4,7-Difluoro-1-indanone #, SCHEMBL783668, AMOT0619, CTK4B6700, DTXSID00343166, KMWBFTTYYGUTNW-UHFFFAOYSA-N, ACT09074, EBD11005, KS-00000OG7, ANW-72335, MFCD07772126, ZINC32180000, AKOS010641468, 4,7-difluoro-2,3-dihydroinden-1-one, AB42243, CD-1877, MCULE-5386782796, AJ-84902, AK-42133, AB0000364, DB-062743, ST2405276, TC-066160, TC-161080, 4CH-019088, FT-0084177, FT-0660179, X9767, B-2092, Z1492796603, C9H6F2O, CID587852, ACN-041047,

Complexity	205
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.039g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	168.143g/mol
Monoisotopic Mass	168.039g/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	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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