AG003FY6

879093-08-0 | 2,5-Difluoro-4-methoxybenzaldehyde

AG003FY6

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CAS Number	879093-08-0
Catalog Number	AG003FY6(AGN-PC-0L12XY)
Chemical Name	2,5-Difluoro-4-methoxybenzaldehyde
IUPAC Name	2,5-difluoro-4-methoxybenzaldehyde
InChI	InChI=1S/C8H6F2O2/c1-12-8-3-6(9)5(4-11)2-7(8)10/h2-4H,1H3
InChI Key	DCGKDDVUUMOTDH-UHFFFAOYSA-N
MDL Number	MFCD06246882
Molecular Formula	C8H6F2O2
Molecular Weight	172.1288
SMILES	O=CC1=CC(F)=C(OC)C=C1F
Synonyms	2,5-difluoro-4-methoxybenzaldehyde, 879093-08-0, 2,5-difluoro-4-methoxy-benzaldehyde, 2,5-fluoro-4-methoxybenzaldehyde, MFCD06246882, AK-36677, AC1MYHWW, PubChem17005, ACMC-209qqk, SCHEMBL436131, CTK5F9127, DTXSID90397416, DCGKDDVUUMOTDH-UHFFFAOYSA-N, ACT03520, 2,5-difluoro-4-methyoxybenzaldehyde, ANW-38922, BBL100711, CL8249, FC1199, FCH835003, SBB088593, STL554505, ZINC36047157, AKOS005255137, Benzaldehyde,2,5-difluoro-4-methoxy-, AM84032, CS-W017627, RP02710, Benzaldehyde, 2,5-difluoro-4-methoxy-, TRA-0177802, AJ-92352, AS-46007, CJ-18860, SC-32464, 2,5-difluoro-4-methoxybenzaldehyde, 97+%, AB0037198, AX8067603, DB-010901, ST2403712, TC-127667, FT-0081533, FT-0648058, Y4452, Q-8064, I01-6637, J-507330, I14-91154, C8H6F2O2, CID3856938, A11591,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.034g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	172.131g/mol
Monoisotopic Mass	172.034g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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