AG002Z19

Name: 1-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)butan-1-one
Brand: Angene Chemical
SKU: AG002Z19

29668-47-1 | 1-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)butan-1-one

AG002Z19

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CAS Number	29668-47-1
Catalog Number	AG002Z19(AGN-PC-0KMRCK)
Chemical Name	1-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)butan-1-one
IUPAC Name	1-(2,3-dihydro-1,4-benzodioxin-6-yl)butan-1-one
InChI	InChI=1S/C12H14O3/c1-2-3-10(13)9-4-5-11-12(8-9)15-7-6-14-11/h4-5,8H,2-3,6-7H2,1H3
InChI Key	XSWZTOLEGWPAAA-UHFFFAOYSA-N
MDL Number	MFCD02601787
Molecular Formula	C12H14O3
Molecular Weight	206.2378
SMILES	C12OCCOC=1C=CC(C(CCC)=O)=C2
Synonyms	29668-47-1, 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-butanone, 1-(2,3-dihydro-1,4-benzodioxin-6-yl)butan-1-one, 1-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)butan-1-one, AC1MFTIA, Cambridge id 7074177, MLS000534755, CHEMBL1430115, CTK4G3631, DTXSID00387848, CHEMBRDG-BB 7074177, HMS2323K03, ZINC4679140, MFCD02601787, STK100449, AKOS003596773, MCULE-7784810038, AJ-51885, SMR000142211, W-9461, SR-01000530579, SR-01000530579-1, 1-(2,3-di-hydro-1,4-benzodioxin-6-yl)butan-1-one, 1-Butanone, 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-, CHEMBRDG-BB7074177, ZINC04679140, CID2925481,

Complexity	227
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	206.094g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	206.241g/mol
Monoisotopic Mass	206.094g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited