AG01AHFF

Name: 5-(3-Cyanophenoxy)pentanoic acid
Brand: Angene Chemical
SKU: AG01AHFF

1038972-84-7 | 5-(3-Cyanophenoxy)pentanoic acid

AG01AHFF

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CAS Number	1038972-84-7
Catalog Number	AG01AHFF
Chemical Name	5-(3-Cyanophenoxy)pentanoic acid
IUPAC Name	5-(3-cyanophenoxy)pentanoic acid
InChI	InChI=1S/C12H13NO3/c13-9-10-4-3-5-11(8-10)16-7-2-1-6-12(14)15/h3-5,8H,1-2,6-7H2,(H,14,15)
InChI Key	QASZYBYQWJDDRF-UHFFFAOYSA-N
MDL Number	MFCD11192993
Molecular Formula	C12H13NO3
Molecular Weight	219.2365
SMILES	OC(CCCCOC1=CC(C#N)=CC=C1)=O
Synonyms	5-(3-cyanophenoxy)pentanoic acid, 1038972-84-7, EN300-74512, SCHEMBL4839630, ZINC20474355, AKOS009260387, MCULE-1034125602, NE27811, Z1259335844,

Complexity	269
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	219.09g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	219.24g/mol
Monoisotopic Mass	219.09g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	70.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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