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Home Sulfos 1-(Phenylsulfonyl)pyrrolidine

1-(Phenylsulfonyl)pyrrolidine

CAS No.:
5033-22-7
Catalog Number:
AG00DACN
Molecular Formula:
C10H13NO2S
Molecular Weight:
211.2807
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$47
- +
5g
98%
In Stock USA
United States
$132
- +
10g
98%
In Stock USA
United States
$250
- +
25g
98%
In Stock USA
United States
$375
- +
100g
98%
In Stock USA
United States
$1125
- +
Product Description
Catalog Number:
AG00DACN
Chemical Name:
1-(Phenylsulfonyl)pyrrolidine
CAS Number:
5033-22-7
Molecular Formula:
C10H13NO2S
Molecular Weight:
211.2807
MDL Number:
MFCD01055979
IUPAC Name:
1-(benzenesulfonyl)pyrrolidine
InChI:
InChI=1S/C10H13NO2S/c12-14(13,11-8-4-5-9-11)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2
InChI Key:
DSWRVRWIXRRDLN-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccccc1)N1CCCC1
NSC Number:
58725
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.279g/mol
Monoisotopic Mass:
211.067g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
Toward prediction of alkane/water partition coefficients. Journal of medicinal chemistry 20080710
Properties