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56609-17-7 | 3-nitro-5-sulphosalicylic acid
CAS No: 56609-17-7 Catalog No: AG00F0B2 MDL No:
Product Description
Catalog Number:
AG00F0B2
Chemical Name:
3-nitro-5-sulphosalicylic acid
CAS Number:
56609-17-7
IUPAC Name:
2-hydroxy-3-nitro-5-sulfobenzoic acid
InChI:
InChI=1S/C7H5NO8S/c9-6-4(7(10)11)1-3(17(14,15)16)2-5(6)8(12)13/h1-2,9H,(H,10,11)(H,14,15,16)
InChI Key:
ULEVDAVOVJCFSJ-UHFFFAOYSA-N
EC Number:
260-284-9
NSC Number:
37273
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.974g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
263.176g/mol
Monoisotopic Mass:
262.974g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
166A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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