AG00DKU6

Name: 3-Carboxy-alpha,alpha-difluorotoluene, 3-Carboxybenzal fluoride
Brand: Angene Chemical
SKU: AG00DKU6

55805-20-4 | 3-Carboxy-alpha,alpha-difluorotoluene, 3-Carboxybenzal fluoride

AG00DKU6

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CAS Number	55805-20-4
Catalog Number	AG00DKU6(AGN-PC-001I63)
Chemical Name	3-Carboxy-alpha,alpha-difluorotoluene, 3-Carboxybenzal fluoride
IUPAC Name	3-(difluoromethyl)benzoic acid
InChI	InChI=1S/C8H6F2O2/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4,7H,(H,11,12)
InChI Key	LIACRDFNWIGRCX-UHFFFAOYSA-N
MDL Number	MFCD17480442
Molecular Formula	C8H6F2O2
Molecular Weight	172.1288
SMILES	O=C(O)C1=CC=CC(C(F)F)=C1
Synonyms	3-(difluoromethyl)benzoic acid, 55805-20-4, 3-Carboxybenzal fluoride, AC1Q72TB, 3-(Difluoromethyl)benzoicacid, SCHEMBL315064, KS-00003RAW, DTXSID00560634, LIACRDFNWIGRCX-UHFFFAOYSA-N, MFCD17480442, ZINC34302449, 3-Carboxy-alpha,alpha-difluorotoluene, AKOS017350284, MCULE-8751352927, NE26160, PS-8664, AJ-87877, EN300-69660, Z1273089255, 3-Carboxy-alpha,alpha-difluorotoluene, 3-Carboxybenzal fluoride,

Complexity	170
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.034g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	172.131g/mol
Monoisotopic Mass	172.034g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^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