AG0071IQ

473416-74-9 | 3-Bromo-6-fluoro-2-methoxybenzaldehyde

AG0071IQ

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CAS Number	473416-74-9
Catalog Number	AG0071IQ(AGN-PC-0WAZ3Z)
Chemical Name	3-Bromo-6-fluoro-2-methoxybenzaldehyde
IUPAC Name	3-bromo-6-fluoro-2-methoxybenzaldehyde
InChI	InChI=1S/C8H6BrFO2/c1-12-8-5(4-11)7(10)3-2-6(8)9/h2-4H,1H3
InChI Key	DDBHANVMIQFWEO-UHFFFAOYSA-N
MDL Number	MFCD09261244
Molecular Formula	C8H6BrFO2
Molecular Weight	233.0344
SMILES	COc1c(Br)ccc(c1C=O)F
Synonyms	3-BROMO-6-FLUORO-2-METHOXYBENZALDEHYDE, 473416-74-9, SCHEMBL2007785, CTK4I9866, DTXSID80624026, DDBHANVMIQFWEO-UHFFFAOYSA-N, MFCD09261244, ZINC90413346, AKOS022193572, MB07190, 3-Bromo-6-fluoro-2-methoxy-benzaldehyde, AC-30565, Benzaldehyde, 3-bromo-6-fluoro-2-methoxy-, 3-Bromo-6-fluoro-2-(methyloxy)benzaldehyde, Z0619, KS-00002452, Q-8013, C8H6BrFO2, CS-4046,

Complexity	165
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	231.954g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	233.036g/mol
Monoisotopic Mass	231.954g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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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