AG004NKB

861928-26-9 | 4-BROMO-5-FLUORO-2-METHYLBENZALDEHYDE

AG004NKB

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CAS Number	861928-26-9
Catalog Number	AG004NKB(AGN-PC-0NI0ZJ)
Chemical Name	4-BROMO-5-FLUORO-2-METHYLBENZALDEHYDE
IUPAC Name	4-bromo-5-fluoro-2-methylbenzaldehyde
InChI	InChI=1S/C8H6BrFO/c1-5-2-7(9)8(10)3-6(5)4-11/h2-4H,1H3
InChI Key	XTCHJHTWCZHFQJ-UHFFFAOYSA-N
MDL Number	MFCD07782049
Molecular Formula	C8H6BrFO
Molecular Weight	217.0350
SMILES	O=CC1=CC(F)=C(Br)C=C1C
Synonyms	4-Bromo-5-fluoro-2-methylbenzaldehyde, 861928-26-9, 4-Bromo-5-fluoro-2-methyl-benzaldehyde, AK-36595, PubChem2102, SCHEMBL15920680, CTK3E7810, KS-00000FFT, DTXSID80479679, XTCHJHTWCZHFQJ-UHFFFAOYSA-N, ACT01083, ANW-49121, CL8339, MFCD07782049, ZINC26893632, AKOS005063837, 2-Methyl-4-bromo-5-fluorobenzaldehyde, AC-2294, AM62122, AS01431, CB-2002, CM11850, DS-0988, FCH1385911, AJ-82713, AN-14076, BC002228, BC686452, BR-36595, CC-18405, Benzaldehyde, 4-bromo-5-fluoro-2-methyl-, AB0027064, AX8010928, DB-006724, TC-137866, 4CH-006880, FT-0602506, ST24028962, W8853, A21240, F10073, S-6089, C-11756, 4-Bromo-5-fluoro-2-methylbenzaldehyde, AldrichCPR, I01-4982, Not Available, C8H6BrFO,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	215.959g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	217.037g/mol
Monoisotopic Mass	215.959g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

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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