AG00IGGJ

Name: 4-((4-Aminophenyl)ethynyl)benzoic acid
Brand: Angene Chemical
SKU: AG00IGGJ

910467-92-4 | 4-((4-Aminophenyl)ethynyl)benzoic acid

AG00IGGJ

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CAS Number	910467-92-4
Catalog Number	AG00IGGJ(AGN-PC-0WQXXB)
Chemical Name	4-((4-Aminophenyl)ethynyl)benzoic acid
IUPAC Name	4-[2-(4-aminophenyl)ethynyl]benzoic acid
InChI	InChI=1S/C15H11NO2/c16-14-9-5-12(6-10-14)2-1-11-3-7-13(8-4-11)15(17)18/h3-10H,16H2,(H,17,18)
InChI Key	XETDUQSABYXZNK-UHFFFAOYSA-N
MDL Number	MFCD14583135
Molecular Formula	C15H11NO2
Molecular Weight	237.2533
SMILES	NC1=CC=C(C=C1)C#CC1=CC=C(C(=O)O)C=C1
Synonyms	4-((4-Aminophenyl)ethynyl)benzoic acid, 910467-92-4, SCHEMBL254959, MFCD14583135, 4-(4-Aminophenylethynyl)benzoic acid, AKOS027339498, ZINC113407075,

Complexity	349
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	237.079g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	237.258g/mol
Monoisotopic Mass	237.079g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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