AI51686
521-24-4 | Sodium 3,4-dioxo-3,4-dihydronaphthalene-1-sulfonate
Manufacturer: A2B Chem
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CatalogNumber
AI51686
ChemicalName
Sodium 3,4-dioxo-3,4-dihydronaphthalene-1-sulfonate
CasNumber
521-24-4
MolecularFormula
C10H5NaO5S
MolecularWeight
260.1985
MdlNumber
MFCD00001700
Smiles
O=C1C(=O)C=C(c2c1cccc2)S(=O)(=O)[O-].[Na+]
Complexity
473
Covalently-bondedUnitCount
2
HeavyAtomCount
17
HydrogenBondAcceptorCount
5
RotatableBondCount
1
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CatalogNumber: AI51686
ChemicalName: Sodium 3,4-dioxo-3,4-dihydronaphthalene-1-sulfonate
CasNumber: 521-24-4
MolecularFormula: C10H5NaO5S
MolecularWeight: 260.1985
MdlNumber: MFCD00001700
Smiles: O=C1C(=O)C=C(c2c1cccc2)S(=O)(=O)[O-].[Na+]
Complexity: 473
Covalently-bondedUnitCount: 2
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
CatalogNumber:
AI51686
ChemicalName:
Sodium 3,4-dioxo-3,4-dihydronaphthalene-1-sulfonate
CasNumber:
521-24-4
MolecularFormula:
C10H5NaO5S
MolecularWeight:
260.1985
MdlNumber:
MFCD00001700
Smiles:
O=C1C(=O)C=C(c2c1cccc2)S(=O)(=O)[O-].[Na+]
Complexity:
473
Covalently-bondedUnitCount:
2
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1cccc2c1c(=O)[nH][nH]c2=O
Complexity: 254
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
Nc1cccc2c1c(=O)[nH][nH]c2=O
Complexity:
254
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: CC(C)OC1=C(C=C(C=C1)[N+](=O)[O-])Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CC(C)OC1=C(C=C(C=C1)[N+](=O)[O-])Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)CC1=CC=CC=C1OC
Complexity: 154
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)CC1=CC=CC=C1OC
Complexity:
154
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__