AG003LMK

853771-90-1 | 4-Methoxy-3-(trifluoromethoxy)benzaldehyde

AG003LMK

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CAS Number	853771-90-1
Catalog Number	AG003LMK(AGN-PC-04PZXH)
Chemical Name	4-Methoxy-3-(trifluoromethoxy)benzaldehyde
IUPAC Name	4-methoxy-3-(trifluoromethoxy)benzaldehyde
InChI	InChI=1S/C9H7F3O3/c1-14-7-3-2-6(5-13)4-8(7)15-9(10,11)12/h2-5H,1H3
InChI Key	FFXBLEVIHWURLC-UHFFFAOYSA-N
MDL Number	MFCD08062376
Molecular Formula	C9H7F3O3
Molecular Weight	220.1453
SMILES	O=CC1=CC=C(OC)C(OC(F)(F)F)=C1
Synonyms	4-Methoxy-3-(trifluoromethoxy)benzaldehyde, 853771-90-1, MFCD08062376, Benzaldehyde, 4-methoxy-3-(trifluoromethoxy)-, SCHEMBL2714465, CTK5F4819, DTXSID00641018, FFXBLEVIHWURLC-UHFFFAOYSA-N, KS-000011GJ, ZX-AP001352, CL9017, PC7534, SBB095896, ZINC12359153, AKOS005258338, PS-7871, AK185920, AX8007411, RT-009744, 4-methoxy-3-(trifluoromethyloxy)benzaldehyde, Benzaldehyde,4-methoxy-3-(trifluoromethoxy)-, X-1255, A841309, 2-Methyl-4-methoxy-5-(trifluoromethoxy)benzaldehyde, 50823-87-5,

Complexity	217
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	220.035g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	220.147g/mol
Monoisotopic Mass	220.035g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	35.5A^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-P280-P305+P351+P338-P304+P340-P405-P501
UN Code

Certificate of Analysis

Lot Number