AG008XEU

110931-79-8 | 5,7-difluoro-3,4-dihydro-2H-naphthalen-1-one

AG008XEU

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CAS Number	110931-79-8
Catalog Number	AG008XEU(AGN-PC-0016Y7)
Chemical Name	5,7-difluoro-3,4-dihydro-2H-naphthalen-1-one
IUPAC Name	5,7-difluoro-3,4-dihydro-2H-naphthalen-1-one
InChI	InChI=1S/C10H8F2O/c11-6-4-8-7(9(12)5-6)2-1-3-10(8)13/h4-5H,1-3H2
InChI Key	WNXVYUPXXGLTSF-UHFFFAOYSA-N
MDL Number	MFCD08544417
Molecular Formula	C10H8F2O
Molecular Weight	182.1667
SMILES	O=C1CCCC2=C1C=C(F)C=C2F
Synonyms	110931-79-8, 5,7-Difluoro-3,4-dihydronaphthalen-1(2H)-one, 5,7-DIFLUORO-3,4-DIHYDRO-2H-NAPHTHALEN-1-ONE, 5,7-difluoro-1-tetralone, 5,7-difluoro-1,2,3,4-tetrahydronaphthalen-1-one, 5, 7-difluoro-1-tetralone, AMOT0477, SCHEMBL8459403, DTXSID90559496, WNXVYUPXXGLTSF-UHFFFAOYSA-N, 2015AA, CD-665, MFCD08544417, ZINC16083125, AKOS012023526, CS-W007233, AJ-68201, AK-43713, DS-14233, DB-032343, FT-0688511, 5,7-difluoro-3,4-dihydro-1(2H)-naphthalenone, 1(2H)-Naphthalenone,5,7-difluoro-3,4-dihydro-, C10H8F2O, ACN-040973, 172366-38-0,

Complexity	217
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	182.054g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	182.17g/mol
Monoisotopic Mass	182.054g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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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