200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 1218989-54-8
1218989-54-8 | Pyrrolidine, 1-[(S)-(1,1-dimethylethyl)sulfinyl]-2-(4-fluorophenyl)-, (2S)-
CAS No: 1218989-54-8 Catalog No: AG0016CT MDL No:MFCD20265632
Product Description
Catalog Number:
AG0016CT
Chemical Name:
Pyrrolidine, 1-[(S)-(1,1-dimethylethyl)sulfinyl]-2-(4-fluorophenyl)-, (2S)-
CAS Number:
1218989-54-8
Molecular Formula:
C14H20FNOS
Molecular Weight:
269.3781
MDL Number:
MFCD20265632
IUPAC Name:
(2S)-1-[(S)-tert-butylsulfinyl]-2-(4-fluorophenyl)pyrrolidine
InChI:
InChI=1S/C14H20FNOS/c1-14(2,3)18(17)16-10-4-5-13(16)11-6-8-12(15)9-7-11/h6-9,13H,4-5,10H2,1-3H3/t13-,18-/m0/s1
InChI Key:
SOHDPWOODHXWCS-UGSOOPFHSA-N
SMILES:
Fc1ccc(cc1)[C@@H]1CCCN1[S@@](=O)C(C)(C)C
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
269.125g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.378g/mol
Monoisotopic Mass:
269.125g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.