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845-10-3 | Methyl Red sodium salt
CAS No: 845-10-3 Catalog No: AG003593 MDL No:MFCD00002426
Product Description
Catalog Number:
AG003593
Chemical Name:
Methyl Red sodium salt
CAS Number:
845-10-3
Molecular Formula:
C15H14N3NaO2
Molecular Weight:
291.2803
MDL Number:
MFCD00002426
IUPAC Name:
sodium;2-[[4-(dimethylamino)phenyl]diazenyl]benzoate
InChI:
InChI=1S/C15H15N3O2.Na/c1-18(2)12-9-7-11(8-10-12)16-17-14-6-4-3-5-13(14)15(19)20;/h3-10H,1-2H3,(H,19,20);/q;+1/p-1
InChI Key:
GNTPCYMJCJNRQB-UHFFFAOYSA-M
SMILES:
CN(c1ccc(cc1)N=Nc1ccccc1C(=O)[O-])C.[Na+]
EC Number:
212-682-9
UNII:
311GZ0QHWN
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.098g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.286g/mol
Monoisotopic Mass:
291.098g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
68.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
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