AG0005S3

Name: 2-Difluoromethyl-benzoic acid methyl ester
Brand: Angene Chemical
SKU: AG0005S3

1018678-48-2 | 2-Difluoromethyl-benzoic acid methyl ester

AG0005S3

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CAS Number	1018678-48-2
Catalog Number	AG0005S3(AGN-PC-0WBS1A)
Chemical Name	2-Difluoromethyl-benzoic acid methyl ester
IUPAC Name	methyl 2-(difluoromethyl)benzoate
InChI	InChI=1S/C9H8F2O2/c1-13-9(12)7-5-3-2-4-6(7)8(10)11/h2-5,8H,1H3
InChI Key	KGOFBYAEKGHAQG-UHFFFAOYSA-N
MDL Number	MFCD16140192
Molecular Formula	C9H8F2O2
Molecular Weight	186.1554
SMILES	COC(=O)C1=CC=CC=C1C(F)F
Synonyms	1018678-48-2, methyl 2-(difluoromethyl)benzoate, 2-DIFLUOROMETHYL-BENZOIC ACID METHYL ESTER, BENZOIC ACID,1-(DIFLUOROMETHYL)-METHYL ESTER, SCHEMBL465679, DTXSID50700740, KGOFBYAEKGHAQG-UHFFFAOYSA-N, BBL101413, MFCD16140192, STL555209, ZINC74938399, AKOS005258377, FCH1174116, Methyl 2-(difluoromethyl)benzoate, 95%, AS-45875, AX8270615, FT-0684568, Z-0688, Benzoic acid, 2-(difluoromethyl)-, methyl ester,

Complexity	183
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	186.049g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	186.158g/mol
Monoisotopic Mass	186.049g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

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