Home Sulfos Benzoic acid, 5-(aminosulfonyl)-4-chloro-2-[(2-furanylmethyl)amino]-,monosodium salt

Benzoic acid, 5-(aminosulfonyl)-4-chloro-2-[(2-furanylmethyl)amino]-,monosodium salt

CAS No.:
41733-55-5
Catalog Number:
AG0075I7
Molecular Formula:
C12H10ClN2NaO5S
Molecular Weight:
352.7260
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
500mg
99%
1 week
United States
$182
- +
1g
99%
1 week
United States
$265
- +
Product Description
Catalog Number:
AG0075I7
Chemical Name:
Benzoic acid, 5-(aminosulfonyl)-4-chloro-2-[(2-furanylmethyl)amino]-,monosodium salt
CAS Number:
41733-55-5
Molecular Formula:
C12H10ClN2NaO5S
Molecular Weight:
352.7260
MDL Number:
MFCD23379919
IUPAC Name:
sodium;4-chloro-2-(furan-2-ylmethylamino)-5-sulfamoylbenzoate
InChI:
InChI=1S/C12H11ClN2O5S.Na/c13-9-5-10(15-6-7-2-1-3-20-7)8(12(16)17)4-11(9)21(14,18)19;/h1-5,15H,6H2,(H,16,17)(H2,14,18,19);/q;+1/p-1
InChI Key:
DLFCAVBMDSKMEY-UHFFFAOYSA-M
SMILES:
[O-]C(=O)c1cc(c(cc1NCc1ccco1)Cl)S(=O)(=O)N.[Na+]
EC Number:
255-526-5
UNII:
101EM454S7
Properties
Complexity:
486  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.99g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
352.721g/mol
Monoisotopic Mass:
351.99g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
134A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties