Home Sulfos 4-[(Piperidin-1-ylsulfonyl)methyl]benzoic acid

4-[(Piperidin-1-ylsulfonyl)methyl]benzoic acid

CAS No.:
1099184-76-5
Catalog Number:
AG00HBN4
Molecular Formula:
C13H17NO4S
Molecular Weight:
283.3434
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$100
- +
5g
97%
In Stock USA
United States
$300
- +
10g
97%
In Stock USA
United States
$525
- +
25g
97%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG00HBN4
Chemical Name:
4-[(Piperidin-1-ylsulfonyl)methyl]benzoic acid
CAS Number:
1099184-76-5
Molecular Formula:
C13H17NO4S
Molecular Weight:
283.3434
MDL Number:
MFCD12754214
IUPAC Name:
4-(piperidin-1-ylsulfonylmethyl)benzoic acid
InChI:
InChI=1S/C13H17NO4S/c15-13(16)12-6-4-11(5-7-12)10-19(17,18)14-8-2-1-3-9-14/h4-7H,1-3,8-10H2,(H,15,16)
InChI Key:
LKYJIOGEHCYIPY-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)CS(=O)(=O)N1CCCCC1
Properties
Complexity:
401  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.088g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
283.342g/mol
Monoisotopic Mass:
283.088g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties