Home Nitros 4-(Cyanosulfanyl)-3-nitrobenzoic acid

4-(Cyanosulfanyl)-3-nitrobenzoic acid

CAS No.:
6083-79-0
Catalog Number:
AG00IARC
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$285
- +
Product Description
Catalog Number:
AG00IARC
Chemical Name:
4-(Cyanosulfanyl)-3-nitrobenzoic acid
CAS Number:
6083-79-0
MDL Number:
MFCD01318041
IUPAC Name:
3-nitro-4-thiocyanatobenzoic acid
InChI:
InChI=1S/C8H4N2O4S/c9-4-15-7-2-1-5(8(11)12)3-6(7)10(13)14/h1-3H,(H,11,12)
InChI Key:
HQDASRYDGNESOF-UHFFFAOYSA-N
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.989g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
224.19g/mol
Monoisotopic Mass:
223.989g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
132A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties