AG01AAL3

Name: 3-(4-Cyanophenoxy)benzoic acid
Brand: Angene Chemical
SKU: AG01AAL3

313549-93-8 | 3-(4-Cyanophenoxy)benzoic acid

AG01AAL3

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CAS Number	313549-93-8
Catalog Number	AG01AAL3
Chemical Name	3-(4-Cyanophenoxy)benzoic acid
IUPAC Name	3-(4-cyanophenoxy)benzoic acid
InChI	InChI=1S/C14H9NO3/c15-9-10-4-6-12(7-5-10)18-13-3-1-2-11(8-13)14(16)17/h1-8H,(H,16,17)
InChI Key	AZKSUIJUHZJOKF-UHFFFAOYSA-N
MDL Number	MFCD00447014
Molecular Formula	C14H9NO3
Molecular Weight	239.2262
SMILES	O=C(O)C1=CC=CC(OC2=CC=C(C#N)C=C2)=C1
Synonyms	3-(4-cyanophenoxy)benzoic acid, 313549-93-8, EN300-68915, 5128-55-2, benzoic acid, 3-(4-cyanophenoxy)-, Cambridge id 5128552, Oprea1_328752, AK-918/40033150, SCHEMBL13268612, CTK8D9844, DTXSID50965574, AZKSUIJUHZJOKF-UHFFFAOYSA-N, ZINC281633, 3-(4-Cyano-phenoxy)-benzoic acid, STK247534, AKOS003245340, IMED815792097, MCULE-7471539927, NE25295, BB 0248043, SR-01000394784, SR-01000394784-1, Z1259273152, AC1LFX1T, AC1Q4RS2, AC1Q733B, AR-1H9149, CID785217, 51652-08-5,

Complexity	338
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	239.058243g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	239.23g/mol
Monoisotopic Mass	239.058243g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	70.3Å²
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.6

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