Name: Name:TERT-BUTYL 2-CARBAMOTHIOYL-4,4-DIFLUOROPYRROLIDINE-1-CARBOXYLATE
Brand: Angene
SKU: AG01EIFO
Rating: 90 (10 reviews)

TERT-BUTYL 2-CARBAMOTHIOYL-4,4-DIFLUOROPYRROLIDINE-1-CARBOXYLATE

CAS No.:

1824332-69-5

Catalog Number:

AG01EIFO

Molecular Formula:

C10H16F2N2O2S

Molecular Weight:

266.3080

Catalog Number:

AG01EIFO

Chemical Name:

TERT-BUTYL 2-CARBAMOTHIOYL-4,4-DIFLUOROPYRROLIDINE-1-CARBOXYLATE

CAS Number:

1824332-69-5

Molecular Formula:

C10H16F2N2O2S

Molecular Weight:

266.3080

MDL Number:

MFCD24546052

IUPAC Name:

tert-butyl 2-carbamothioyl-4,4-difluoropyrrolidine-1-carboxylate

InChI:

InChI=1S/C10H16F2N2O2S/c1-9(2,3)16-8(15)14-5-10(11,12)4-6(14)7(13)17/h6H,4-5H2,1-3H3,(H2,13,17)

InChI Key:

XZAOXPVPLDOTEY-UHFFFAOYSA-N

SMILES:

O=C(N1CC(CC1C(=S)N)(F)F)OC(C)(C)C

Complexity:

342

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

266.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

266.307g/mol

Monoisotopic Mass:

266.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

87.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5