Name: Name:METHYL 4-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]AMINO)BUTANOATE
Brand: Angene
SKU: AG00BYSN
Rating: 90 (10 reviews)

METHYL 4-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]AMINO)BUTANOATE

CAS No.:

332361-10-1

Catalog Number:

AG00BYSN

Molecular Formula:

C11H12ClF3N2O2

Molecular Weight:

296.6734

Catalog Number:

AG00BYSN

Chemical Name:

METHYL 4-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]AMINO)BUTANOATE

CAS Number:

332361-10-1

Molecular Formula:

C11H12ClF3N2O2

Molecular Weight:

296.6734

MDL Number:

MFCD00172609

IUPAC Name:

methyl 4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoate

InChI:

InChI=1S/C11H12ClF3N2O2/c1-19-9(18)3-2-4-16-10-8(12)5-7(6-17-10)11(13,14)15/h5-6H,2-4H2,1H3,(H,16,17)

InChI Key:

BWMGEOWYULCWDW-UHFFFAOYSA-N

SMILES:

COC(=O)CCCNc1ncc(cc1Cl)C(F)(F)F

Complexity:

302

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

296.054g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

296.674g/mol

Monoisotopic Mass:

296.054g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

51.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9