AG00DB1S

497224-12-1 | 5-Bromo-2-fluoro-4-methylbenzaldehyde

AG00DB1S

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CAS Number	497224-12-1
Catalog Number	AG00DB1S(AGN-PC-078JPP)
Chemical Name	5-Bromo-2-fluoro-4-methylbenzaldehyde
IUPAC Name	5-bromo-2-fluoro-4-methylbenzaldehyde
InChI	InChI=1S/C8H6BrFO/c1-5-2-8(10)6(4-11)3-7(5)9/h2-4H,1H3
InChI Key	OIPJSBVLNNCQPF-UHFFFAOYSA-N
MDL Number	MFCD04112582
Molecular Formula	C8H6BrFO
Molecular Weight	217.0350
SMILES	BrC1=CC(=C(C=C1C)F)C=O
Synonyms	5-BROMO-2-FLUORO-4-METHYLBENZALDEHYDE, 497224-12-1, BENZALDEHYDE, 5-BROMO-2-FLUORO-4-METHYL-, 5-Bromo-2-fluoro-4-methyl benzaldehyde, AK-35327, PubChem15256, SCHEMBL1517367, CTK4J1605, KS-00000HSN, DTXSID00660587, OIPJSBVLNNCQPF-UHFFFAOYSA-N, ZINC2526753, ANW-49544, CL8367, MFCD04112582, 3-bromo-6-fluoro-4-methylbenzaldehyde, AKOS015919991, AM82999, AS04973, CS-W005371, DS-0883, FCH1366816, LF10673, ACM497224121, AJ-37707, BC003996, BR-35327, CJ-08919, PC501543, AB0025119, AX8160868, TC-138289, 4CH-008641, ST24029370, W6527, 5-bromanyl-2-fluoranyl-4-methyl-benzaldehyde, S-5534, A827828, 5-Bromo-2-fluoro-4-methylbenzaldehyde, AldrichCPR, C8H6BrFO, (1-(5-CARBOXYPENTYL)-3,3-DIMETHYL-3H-INDOL-1-IUM-2-YL)METHANIDE HYDROBROMIDE,

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	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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