AG00941F

Name: 3-Carboxy-alpha,alpha,alpha,2-tetrafluoroanisole
Brand: Angene Chemical
SKU: AG00941F

1159512-62-5 | 3-Carboxy-alpha,alpha,alpha,2-tetrafluoroanisole

AG00941F

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CAS Number	1159512-62-5
Catalog Number	AG00941F(AGN-PC-0WNMKM)
Chemical Name	3-Carboxy-alpha,alpha,alpha,2-tetrafluoroanisole
IUPAC Name	2-fluoro-3-(trifluoromethoxy)benzoic acid
InChI	InChI=1S/C8H4F4O3/c9-6-4(7(13)14)2-1-3-5(6)15-8(10,11)12/h1-3H,(H,13,14)
InChI Key	VUFVRYWIHCPNGN-UHFFFAOYSA-N
MDL Number	MFCD12026477
Molecular Formula	C8H4F4O3
Molecular Weight	224.1092
SMILES	FC1=C(C(=O)O)C=CC=C1OC(F)(F)F
Synonyms	2-Fluoro-3-(trifluoromethoxy)benzoic acid, 1159512-62-5, 3-Carboxy-alpha,alpha,alpha,2-tetrafluoroanisole, MFCD12026477, ACMC-2099rg, SCHEMBL16093747, CTK7I8812, DTXSID40672902, ZX-AP002717, ANW-16922, PC6353, SBB096609, ZINC36533795, AKOS024262844, PS-7793, QC-3744, KS-00000T97, BL009321, AB0065565, RT-016646, CS-0084349, Z7744, B-6496, J-003345, C8H4F4O3, 2-fluoro-3-(trifluoromethoxy)benzoic acid, 95% - 1G 1g,

Complexity	241
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	224.01g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	224.111g/mol
Monoisotopic Mass	224.01g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

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