AG01AH2R

Name: 4-[4-(Cyanomethyl)phenoxy]benzoic acid
Brand: Angene Chemical
SKU: AG01AH2R

1021144-57-9 | 4-[4-(Cyanomethyl)phenoxy]benzoic acid

AG01AH2R

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CAS Number	1021144-57-9
Catalog Number	AG01AH2R
Chemical Name	4-[4-(Cyanomethyl)phenoxy]benzoic acid
IUPAC Name	4-[4-(cyanomethyl)phenoxy]benzoic acid
InChI	InChI=1S/C15H11NO3/c16-10-9-11-1-5-13(6-2-11)19-14-7-3-12(4-8-14)15(17)18/h1-8H,9H2,(H,17,18)
InChI Key	XSEZPZNMAQLSOI-UHFFFAOYSA-N
MDL Number	MFCD12452313
Molecular Formula	C15H11NO3
Molecular Weight	253.2527
SMILES	OC(C1=CC=C(OC2=CC=C(CC#N)C=C2)C=C1)=O
Synonyms	4-[4-(cyanomethyl)phenoxy]benzoic acid, 1021144-57-9, ZINC20080674, AKOS000264319, MCULE-5163071898, NE39866, EN300-73517, Z1374884383,

Complexity	344
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	253.074g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	253.257g/mol
Monoisotopic Mass	253.074g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	70.3A^2
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