AG009SVT

Name: 4-(3,3,3-trifluoropropyl)benzoic acid
Brand: Angene Chemical
SKU: AG009SVT

104958-55-6 | 4-(3,3,3-trifluoropropyl)benzoic acid

AG009SVT

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COA

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CAS Number	104958-55-6
Catalog Number	AG009SVT(AGN-PC-00N7N6)
Chemical Name	4-(3,3,3-trifluoropropyl)benzoic acid
IUPAC Name	4-(3,3,3-trifluoropropyl)benzoic acid
InChI	InChI=1S/C10H9F3O2/c11-10(12,13)6-5-7-1-3-8(4-2-7)9(14)15/h1-4H,5-6H2,(H,14,15)
InChI Key	QDORDVFNPUQXDL-UHFFFAOYSA-N
MDL Number	MFCD22741178
Molecular Formula	C10H9F3O2
Molecular Weight	218.1725
SMILES	OC(C1=CC=C(CCC(F)(F)F)C=C1)=O
Synonyms	4-(3,3,3-trifluoropropyl)benzoic acid, 104958-55-6, Benzoic acid, 4-(3,3,3-trifluoropropyl)-, SCHEMBL14089940, CTK8G4979, ZINC34101506, AKOS023601402, MCULE-3622175290, F2167-7446, Z1507502855,

Complexity	217
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	218.055g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	218.175g/mol
Monoisotopic Mass	218.055g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

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