AG000RWH

126162-95-6 | Benzaldehyde, 4-ethoxy-2,3-difluoro-

AG000RWH

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CAS Number	126162-95-6
Catalog Number	AG000RWH(AGN-PC-0WANM6)
Chemical Name	Benzaldehyde, 4-ethoxy-2,3-difluoro-
IUPAC Name	4-ethoxy-2,3-difluorobenzaldehyde
InChI	InChI=1S/C9H8F2O2/c1-2-13-7-4-3-6(5-12)8(10)9(7)11/h3-5H,2H2,1H3
InChI Key	DYASUFNACNHJMK-UHFFFAOYSA-N
MDL Number	MFCD09258700
Molecular Formula	C9H8F2O2
Molecular Weight	186.1554
SMILES	c1(c(ccc(c1F)C=O)OCC)F
Synonyms	4-Ethoxy-2,3-difluorobenzaldehyde, 126162-95-6, MFCD09258700, SCHEMBL2544586, CTK6G1540, DTXSID90560986, DYASUFNACNHJMK-UHFFFAOYSA-N, 2,3-difluoro-4-ethoxybenzaldehyde, KS-00000Z1V, 4-ethoxy-2,3-difluoro-benzaldehyde, 5049AA, SBB090373, ZINC16159447, AKOS015956713, Benzaldehyde, 4-ethoxy-2,3-difluoro-, PS-8475, AJ-68668, AN-32494, DA-18183, 4-ETHOXY-2,3-DIFLUORO BENZALDEHYDE, FT-0723617, C9H8F2O2,

Complexity	175
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	186.049g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	186.158g/mol
Monoisotopic Mass	186.049g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

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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