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Home Sulfos 2-Naphthalenecarboxylic acid,3-hydroxy-4-[(2-hydroxy-4-sulfo-1-naphthalenyl)azo]-

2-Naphthalenecarboxylic acid,3-hydroxy-4-[(2-hydroxy-4-sulfo-1-naphthalenyl)azo]-

CAS No.:
3737-95-9
Catalog Number:
AG00I7CW
Molecular Formula:
C16H12O3
Molecular Weight:
252.2647
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
1 week
United States
$67
- +
100g
1 week
United States
$126
- +
250g
1 week
United States
$213
- +
Product Description
Catalog Number:
AG00I7CW
Chemical Name:
2-Naphthalenecarboxylic acid,3-hydroxy-4-[(2-hydroxy-4-sulfo-1-naphthalenyl)azo]-
CAS Number:
3737-95-9
Molecular Formula:
C16H12O3
Molecular Weight:
252.2647
MDL Number:
MFCD00004078
IUPAC Name:
3-hydroxy-4-[(2-hydroxy-4-sulfonaphthalen-1-yl)diazenyl]naphthalene-2-carboxylic acid
InChI:
InChI=1S/C21H14N2O7S/c24-16-10-17(31(28,29)30)13-7-3-4-8-14(13)18(16)22-23-19-12-6-2-1-5-11(12)9-15(20(19)25)21(26)27/h1-10,24-25H,(H,26,27)(H,28,29,30)
InChI Key:
MVQBFZXBLLMXGS-UHFFFAOYSA-N
SMILES:
OC(=O)/C(=C\c1ccccc1)/C(=O)c1ccccc1
EC Number:
223-117-0
NSC Number:
97307
Properties
Complexity:
798  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
438.052g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
438.41g/mol
Monoisotopic Mass:
438.052g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
165A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  
Literature
Title Journal
Coupling solid-phase microextraction and laser desorption ionization for rapid identification of biological material. Rapid communications in mass spectrometry : RCM 20120415
Non-peptidic anti-AIDS agents: inhibition of HIV-1 proteinase by disulfonates. Biochemical and biophysical research communications 19921030
Properties