AG003FY0

4686-98-0 | 2,5-Diethoxybenzaldehyde

AG003FY0

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CAS Number	4686-98-0
Catalog Number	AG003FY0(AGN-PC-0KUCAY)
Chemical Name	2,5-Diethoxybenzaldehyde
IUPAC Name	2,5-diethoxybenzaldehyde
InChI	InChI=1S/C11H14O3/c1-3-13-10-5-6-11(14-4-2)9(7-10)8-12/h5-8H,3-4H2,1-2H3
InChI Key	UGNJILDLOHTRMK-UHFFFAOYSA-N
MDL Number	MFCD02093696
Molecular Formula	C11H14O3
Molecular Weight	194.2271
SMILES	O=CC1C(OCC)=CC=C(OCC)C=1
Synonyms	2,5-Diethoxybenzaldehyde, 4686-98-0, Benzaldehyde, 2,5-diethoxy-, ACMC-20aob3, AC1MPF8N, SCHEMBL271557, AC1Q362M, 2,5-Diethoxybenzaldehyde, 97%, CTK4I9611, DTXSID30392445, UGNJILDLOHTRMK-UHFFFAOYSA-N, ZINC2389323, MFCD02093696, AKOS003809429, AJ-35569, AK122368, TC-171174, X4579, I01-17633, C11H14O3, CID3434314,

Complexity	170
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	194.094g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	194.23g/mol
Monoisotopic Mass	194.094g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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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