AG000XRI

1280786-80-2 | Benzaldehyde, 5-bromo-3-chloro-2-fluoro-

AG000XRI

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CAS Number	1280786-80-2
Catalog Number	AG000XRI(AGN-PC-08YIU0)
Chemical Name	Benzaldehyde, 5-bromo-3-chloro-2-fluoro-
IUPAC Name	5-bromo-3-chloro-2-fluorobenzaldehyde
InChI	InChI=1S/C7H3BrClFO/c8-5-1-4(3-11)7(10)6(9)2-5/h1-3H
InChI Key	PLYXMAYYYOIEJW-UHFFFAOYSA-N
MDL Number	MFCD18783162
Molecular Formula	C7H3BrClFO
Molecular Weight	237.4535
SMILES	O=CC1=CC(Br)=CC(Cl)=C1F
Synonyms	5-BROMO-3-CHLORO-2-FLUOROBENZALDEHYDE, 1280786-80-2, ACMC-209be4, SCHEMBL16722745, CTK8A9977, DTXSID80679617, ANW-19034, MFCD18783162, ZINC65337171, AKOS015888472, FCH1342914, AK-89213, AS-19835, CJ-21036, Benzaldehyde, 5-bromo-3-chloro-2-fluoro-, AJ-115026, AX8239663, TC-107779, CS-0063866, ST24023938, A-3335, 5-Bromo-3-chloro-2-fluorobenzaldehyde, AldrichCPR, I01-10892, C7H3BrClFO, ACN-056149, Z0014,

Complexity	155
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	235.904g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	237.452g/mol
Monoisotopic Mass	235.904g/mol
Rotatable Bond Count	1
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	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number