AD19664
51595-55-2 | 4,4'-Dinitro-2,2'-bipyridine,n,n-dioxide
Manufacturer: A2B Chem
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CatalogNumber
AD19664
ChemicalName
4,4'-Dinitro-2,2'-bipyridine,n,n-dioxide
CasNumber
51595-55-2
MolecularFormula
C10H6N4O6
MolecularWeight
278.1778
MdlNumber
MFCD00065175
Smiles
[O-][N+](=O)c1cc[n+](c(c1)c1cc(cc[n+]1[O-])[N+](=O)[O-])[O-]
Complexity
603
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
7
UndefinedBondStereocenterCount
1
Xlogp3
-0.2
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CatalogNumber: AD19664
ChemicalName: 4,4'-Dinitro-2,2'-bipyridine,n,n-dioxide
CasNumber: 51595-55-2
MolecularFormula: C10H6N4O6
MolecularWeight: 278.1778
MdlNumber: MFCD00065175
Smiles: [O-][N+](=O)c1cc[n+](c(c1)c1cc(cc[n+]1[O-])[N+](=O)[O-])[O-]
Complexity: 603
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 7
UndefinedBondStereocenterCount: 1
Xlogp3: -0.2
CatalogNumber:
AD19664
ChemicalName:
4,4'-Dinitro-2,2'-bipyridine,n,n-dioxide
CasNumber:
51595-55-2
MolecularFormula:
C10H6N4O6
MolecularWeight:
278.1778
MdlNumber:
MFCD00065175
Smiles:
[O-][N+](=O)c1cc[n+](c(c1)c1cc(cc[n+]1[O-])[N+](=O)[O-])[O-]
Complexity:
603
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
7
UndefinedBondStereocenterCount:
1
Xlogp3:
-0.2
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Smiles: COc1ccc2c(c1)c1cc(C)ccc1[nH]2
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Smiles:
COc1ccc2c(c1)c1cc(C)ccc1[nH]2
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Smiles: ClC(=CC1C(C1(C)C)C(=O)OCc1cccc(c1)Oc1ccccc1)Cl
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Smiles:
ClC(=CC1C(C1(C)C)C(=O)OCc1cccc(c1)Oc1ccccc1)Cl
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HeavyAtomCount:
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Smiles: CC=CCC/C(=C/CC/C(=C/CC/C(=C/CC1=C(C)C(=O)c2c(C1=O)cccc2)/C)/C)/C
Complexity: __
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Smiles:
CC=CCC/C(=C/CC/C(=C/CC/C(=C/CC1=C(C)C(=O)c2c(C1=O)cccc2)/C)/C)/C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
UndefinedBondStereocenterCount:
__
Xlogp3:
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