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20368-79-0 | 1,4-Benzenediol, mono(dihydrogen phosphate), disodium salt (9CI)
CAS No: 20368-79-0 Catalog No: AG002932 MDL No:MFCD26406259
Product Description
Catalog Number:
AG002932
Chemical Name:
1,4-Benzenediol, mono(dihydrogen phosphate), disodium salt (9CI)
CAS Number:
20368-79-0
Molecular Formula:
C6H5Na2O5P
Molecular Weight:
234.0542
MDL Number:
MFCD26406259
IUPAC Name:
disodium;(4-hydroxyphenyl) phosphate
InChI:
InChI=1S/C6H7O5P.2Na/c7-5-1-3-6(4-2-5)11-12(8,9)10;;/h1-4,7H,(H2,8,9,10);;/q;2*+1/p-2
InChI Key:
JOYKXZZXDRGNST-UHFFFAOYSA-L
SMILES:
Oc1ccc(cc1)OP(=O)([O-])[O-].[Na+].[Na+]
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.967g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.054g/mol
Monoisotopic Mass:
233.967g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
92.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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