Name: Name:Methyl (S)-1-Boc-3-fluoropyrrolidine-3-carboxylate
Brand: Angene
SKU: AG00HWZI
Rating: 90 (10 reviews)

Methyl (S)-1-Boc-3-fluoropyrrolidine-3-carboxylate

CAS No.:

1438852-71-1

Catalog Number:

AG00HWZI

Molecular Formula:

C11H18FNO4

Molecular Weight:

247.2633

Catalog Number:

AG00HWZI

Chemical Name:

Methyl (S)-1-Boc-3-fluoropyrrolidine-3-carboxylate

CAS Number:

1438852-71-1

Molecular Formula:

C11H18FNO4

Molecular Weight:

247.2633

MDL Number:

MFCD27986980

IUPAC Name:

1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate

InChI:

InChI=1S/C11H18FNO4/c1-10(2,3)17-9(15)13-6-5-11(12,7-13)8(14)16-4/h5-7H2,1-4H3/t11-/m0/s1

InChI Key:

WJXDMHSZPKIZKP-NSHDSACASA-N

SMILES:

COC(=O)[C@]1(F)CCN(C1)C(=O)OC(C)(C)C

Complexity:

326

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

247.122g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

247.266g/mol

Monoisotopic Mass:

247.122g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4