Home Sulfos 1-(butane-1-sulfonyl)pyrrolidine-2-carboxylic acid

1-(butane-1-sulfonyl)pyrrolidine-2-carboxylic acid

CAS No.:
1160562-35-5
Catalog Number:
AG01EKAN
Molecular Formula:
C9H17NO4S
Molecular Weight:
235.3006
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01EKAN
Chemical Name:
1-(butane-1-sulfonyl)pyrrolidine-2-carboxylic acid
CAS Number:
1160562-35-5
Molecular Formula:
C9H17NO4S
Molecular Weight:
235.3006
MDL Number:
MFCD08445030
IUPAC Name:
1-butylsulfonylpyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C9H17NO4S/c1-2-3-7-15(13,14)10-6-4-5-8(10)9(11)12/h8H,2-7H2,1H3,(H,11,12)
InChI Key:
NSVGZDWWWLPNFH-UHFFFAOYSA-N
SMILES:
CCCCS(=O)(=O)N1CCCC1C(=O)O
Properties
Complexity:
320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.088g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
235.298g/mol
Monoisotopic Mass:
235.088g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties