AG000ZZ5

13195-79-4 | Ethanone, 2,2-dibromo-1-(4-bromophenyl)-

AG000ZZ5

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CAS Number	13195-79-4
Catalog Number	AG000ZZ5(AGN-PC-0JKIE0)
Chemical Name	Ethanone, 2,2-dibromo-1-(4-bromophenyl)-
EC Number	236-161-0
IUPAC Name	2,2-dibromo-1-(4-bromophenyl)ethanone
InChI	InChI=1S/C8H5Br3O/c9-6-3-1-5(2-4-6)7(12)8(10)11/h1-4,8H
InChI Key	KFTUNOVZJWIKFX-UHFFFAOYSA-N
MDL Number	MFCD00017858
Molecular Formula	C8H5Br3O
Molecular Weight	356.8367
NSC Number	78440
SMILES	BrC(C(C1=CC=C(Br)C=C1)=O)Br
Synonyms	13195-79-4, 2,2-Dibromo-1-(4-bromophenyl)ethanone, 2,2,4'-Tribromoacetophenone, 2,2-Dibromo-1-(4-bromophenyl)ethan-1-one, ACETOPHENONE, 2,2,4'-TRIBROMO-, 4alpha,alpha-Tribromoacetophenone, 4,alpha,alpha-Tribromoacetophenone, EINECS 236-161-0, NSC 78440, p,alpha,alpha-TRIBROMOACETOPHENONE, BRN 1949157, Ethanone, 2,2-dibromo-1-(4-bromophenyl)-, alpha,alpha,4-Tribromoacetophenone, MFCD00017858, C8H5Br3O, NSC78440, WLN: EYEVR DE, 2,4'-Tribromoacetophenone, p-bromo-benzoyldibromomethane, 3-07-00-00987 (Beilstein Handbook Reference), Acetophenone,2,4'-tribromo-, AC1L19Q6, SCHEMBL2096724, DTXSID90157279, alpha,alpha,p-Tribromoacetophenone, ZINC942489, alpha,alpha,4'-Tribromoacetophenone, 8036AF, NSC-78440, STL268875, 4.alpha.,.alpha.-Tribromoacetophenone, AKOS001325164, MCULE-3826776594, NE10783, alpha,alpha,p-Tribromoacetophenone, 97%, Ethanone,2-dibromo-1-(4-bromophenyl)-, 2,2-dibromo-1-(4-bromophenyl)-ethanone, LS-13725, FT-0622077, ST50109483, 2,2-bis(bromanyl)-1-(4-bromophenyl)ethanone, A806344, Ethanone, 2,2-dibromo-1-(4-bromophenyl)- (9CI), J-006094, S01-0558, 2,2,4-Tribromoacetophenone,97% (alpha,alpha,4-Tribromoacetophenone), C8-H5-Br3-O, Acetophenone, 2,2,4/'-tribromo-, CID25776,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	355.787g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	356.839g/mol
Monoisotopic Mass	353.789g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H314
Precuationary statements	P280-P305+P351+P338-P310
Siginal words

Certificate of Analysis

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