AG000QPI

1260007-55-3 | 1(2H)-Naphthalenone, 5-bromo-6-fluoro-3,4-dihydro-

AG000QPI

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CAS Number	1260007-55-3
Catalog Number	AG000QPI(AGN-PC-0WAM95)
Chemical Name	1(2H)-Naphthalenone, 5-bromo-6-fluoro-3,4-dihydro-
IUPAC Name	5-bromo-6-fluoro-3,4-dihydro-2H-naphthalen-1-one
InChI	InChI=1S/C10H8BrFO/c11-10-7-2-1-3-9(13)6(7)4-5-8(10)12/h4-5H,1-3H2
InChI Key	IYENTJQOLSXUQB-UHFFFAOYSA-N
MDL Number	MFCD18207826
Molecular Formula	C10H8BrFO
Molecular Weight	243.0723
SMILES	O=C1CCCC2=C1C=CC(F)=C2Br
Synonyms	1260007-55-3, 5-Bromo-6-fluoro-3,4-dihydronaphthalen-1(2H)-one, 5-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-1-one, 5-bromo-6-fluoro-3,4-dihydro-2H-naphthalen-1-one, AK172657, 5-Bromo-6-fluoro-1-tetralone, AMOT0598, SCHEMBL19949080, KS-00000SZZ, DTXSID40744315, 3275AD, MFCD18207826, ZINC77024706, AKOS025395719, CB-4184, DS-8122, EBD2333283, FCH1364363, SC-89856, AX8297005, CS-0037861, 1(2H)-Naphthalenone, 5-bromo-6-fluoro-3,4-dihydro-, 5-Bromo-6-fluoro-1,2,3,4-tetrahydronaphthalene-1-one, C10H8BrFO, ACN-040986,

Complexity	219
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	241.974g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	243.075g/mol
Monoisotopic Mass	241.974g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

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

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