AG019U8I

Name: 5-(2-Phenylethynyl)furan-3-carboxylic acid
Brand: Angene Chemical
SKU: AG019U8I

1111580-55-2 | 5-(2-Phenylethynyl)furan-3-carboxylic acid

AG019U8I

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CAS Number	1111580-55-2
Catalog Number	AG019U8I
Chemical Name	5-(2-Phenylethynyl)furan-3-carboxylic acid
IUPAC Name	5-(2-phenylethynyl)furan-3-carboxylic acid
InChI	InChI=1S/C13H8O3/c14-13(15)11-8-12(16-9-11)7-6-10-4-2-1-3-5-10/h1-5,8-9H,(H,14,15)
InChI Key	AAZNXBGLAHTTGA-UHFFFAOYSA-N
MDL Number	MFCD11839727
Molecular Formula	C13H8O3
Molecular Weight	212.2008
SMILES	OC(C1C=C(C#CC2=CC=CC=C2)OC=1)=O
Synonyms	5-(2-phenylethynyl)furan-3-carboxylic acid, 5-(phenylethynyl)-3-furoic acid, 1111580-55-2, AC1Q741G, CTK7J0680, ZINC32627911, AKOS034299651, MCULE-2026806454, NE53212, EN300-40899,

Complexity	317
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	212.047g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	212.204g/mol
Monoisotopic Mass	212.047g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	50.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

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