200,000+ products from a single source!
sales@angenechem.com
164666-07-3 | 1-Pyrrolidinecarboxylic acid, 3-(methylthio)-, 1,1-dimethylethyl ester
CAS No: 164666-07-3 Catalog No: AG001V16 MDL No:MFCD16660043
Product Description
Catalog Number:
AG001V16
Chemical Name:
1-Pyrrolidinecarboxylic acid, 3-(methylthio)-, 1,1-dimethylethyl ester
CAS Number:
164666-07-3
Molecular Formula:
C10H19NO2S
Molecular Weight:
217.3284
MDL Number:
MFCD16660043
IUPAC Name:
tert-butyl 3-methylsulfanylpyrrolidine-1-carboxylate
InChI:
InChI=1S/C10H19NO2S/c1-10(2,3)13-9(12)11-6-5-8(7-11)14-4/h8H,5-7H2,1-4H3
InChI Key:
RFFVIHRYBTXYFL-UHFFFAOYSA-N
SMILES:
CSC1CCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.114g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.327g/mol
Monoisotopic Mass:
217.114g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.