Home Sulfos 2,7-diamino-1,3-benzoxazole-5-sulfonic acid

2,7-diamino-1,3-benzoxazole-5-sulfonic acid

CAS No.:
1820649-69-1
Catalog Number:
AG00I0ON
Molecular Formula:
C7H7N3O4S
Molecular Weight:
229.2132
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$250
- +
1g
95%
In Stock USA
United States
$625
- +
Product Description
Catalog Number:
AG00I0ON
Chemical Name:
2,7-diamino-1,3-benzoxazole-5-sulfonic acid
CAS Number:
1820649-69-1
Molecular Formula:
C7H7N3O4S
Molecular Weight:
229.2132
MDL Number:
MFCD28166450
IUPAC Name:
2,7-diamino-1,3-benzoxazole-5-sulfonic acid
InChI:
InChI=1S/C7H7N3O4S/c8-4-1-3(15(11,12)13)2-5-6(4)14-7(9)10-5/h1-2H,8H2,(H2,9,10)(H,11,12,13)
InChI Key:
TZILYVKMWQQPCP-UHFFFAOYSA-N
SMILES:
Nc1cc(cc2c1oc(n2)N)S(=O)(=O)O
Properties
Complexity:
341  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.016g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
229.21g/mol
Monoisotopic Mass:
229.016g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
141A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Properties