AG00ECE6

Name: 4,5-Diamino-3-fluoro-2-phenylaminobenzoic acid methyl ester
Brand: Angene Chemical
SKU: AG00ECE6

606144-42-7 | 4,5-Diamino-3-fluoro-2-phenylaminobenzoic acid methyl ester

AG00ECE6

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CAS Number	606144-42-7
Catalog Number	AG00ECE6(AGN-PC-0BEP2Z)
Chemical Name	4,5-Diamino-3-fluoro-2-phenylaminobenzoic acid methyl ester
IUPAC Name	methyl 4,5-diamino-2-anilino-3-fluorobenzoate
InChI	InChI=1S/C14H14FN3O2/c1-20-14(19)9-7-10(16)12(17)11(15)13(9)18-8-5-3-2-4-6-8/h2-7,18H,16-17H2,1H3
InChI Key	JHIJEIVUKKHRAU-UHFFFAOYSA-N
MDL Number	MFCD18642904
Molecular Formula	C14H14FN3O2
Molecular Weight	275.2783
SMILES	C1(NC2=C(C(OC)=O)C=C(N)C(N)=C2F)=CC=CC=C1
Synonyms	methyl 4,5-diamino-3-fluoro-2-(phenylamino)benzoate, 606144-42-7, 4,5-Diamino-3-fluoro-2-phenylaminobenzoic acid methyl ester, SCHEMBL4545983, JHIJEIVUKKHRAU-UHFFFAOYSA-N, CS-M0963, 3830AH, ZINC71792968, CS-13746, 4,5-Diamino-3-fluoro-2-phenylamino-benzoic acid methyl ester, C14H14FN3O2,

Complexity	336
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	275.107g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	275.283g/mol
Monoisotopic Mass	275.107g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	90.4A^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