AG005PDR

Name: 3,5-Dimethoxybenzoylacetonitrile
Brand: Angene Chemical
SKU: AG005PDR

70988-04-4 | 3,5-Dimethoxybenzoylacetonitrile

AG005PDR

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CAS Number	70988-04-4
Catalog Number	AG005PDR(AGN-PC-0TYMG9)
Chemical Name	3,5-Dimethoxybenzoylacetonitrile
IUPAC Name	3-(3,5-dimethoxyphenyl)-3-oxopropanenitrile
InChI	InChI=1S/C11H11NO3/c1-14-9-5-8(11(13)3-4-12)6-10(7-9)15-2/h5-7H,3H2,1-2H3
InChI Key	LKMXJVUYRSDTPZ-UHFFFAOYSA-N
MDL Number	MFCD00158877
Molecular Formula	C11H11NO3
Molecular Weight	205.2099
SMILES	C1(=CC(OC)=CC(C(=O)CC#N)=C1)OC
Synonyms	3-(3,5-dimethoxyphenyl)-3-oxopropanenitrile, 70988-04-4, 3,5-Dimethoxybenzoylacetonitrile, 3,5-dimethoxbenzoylacetonitrile, Benzenepropanenitrile,3,5-dimethoxy-b-oxo-, PubChem11969, AC1Q496T, SCHEMBL1915774, CTK5D3304, DTXSID10606557, LKMXJVUYRSDTPZ-UHFFFAOYSA-N, ZINC2531004, ZX-AT005258, 8524AE, BBL013465, KM1382, MFCD00158877, SBB093472, STL124116, AKOS000181019, BA-0800, BBV-073333, MCULE-2511771065, OR15170, RP11944, KS-000022S7, TR-023414, A9329, FT-0604173, C-55828, J-510578, I14-29001, C11H11NO3, 2-hydrazinyl-3-(trifluoromethyl)pyridine,

Complexity	256
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.074g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	205.213g/mol
Monoisotopic Mass	205.074g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	59.3A^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