AI53537
60781-34-2 | Ethyl 2-(2-nitrophenylsulfonyl)acetate
Manufacturer: A2B Chem
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CatalogNumber
AI53537
ChemicalName
Ethyl 2-(2-nitrophenylsulfonyl)acetate
CasNumber
60781-34-2
MolecularFormula
C10H11NO6S
MolecularWeight
273.2624
MdlNumber
MFCD02976182
Smiles
CCOC(=O)CS(=O)(=O)c1ccccc1[N+](=O)[O-]
Complexity
407
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
6
RotatableBondCount
5
Xlogp3
1.3
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CatalogNumber: AI53537
ChemicalName: Ethyl 2-(2-nitrophenylsulfonyl)acetate
CasNumber: 60781-34-2
MolecularFormula: C10H11NO6S
MolecularWeight: 273.2624
MdlNumber: MFCD02976182
Smiles: CCOC(=O)CS(=O)(=O)c1ccccc1[N+](=O)[O-]
Complexity: 407
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 6
RotatableBondCount: 5
Xlogp3: 1.3
CatalogNumber:
AI53537
ChemicalName:
Ethyl 2-(2-nitrophenylsulfonyl)acetate
CasNumber:
60781-34-2
MolecularFormula:
C10H11NO6S
MolecularWeight:
273.2624
MdlNumber:
MFCD02976182
Smiles:
CCOC(=O)CS(=O)(=O)c1ccccc1[N+](=O)[O-]
Complexity:
407
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
6
RotatableBondCount:
5
Xlogp3:
1.3
CatalogNumber: AI53538
ChemicalName: 2-Amino-4-phenylpyridine
CasNumber: 60781-83-1
MolecularFormula: C11H10N2
MolecularWeight: 170.2105
MdlNumber: MFCD00137848
Smiles: Nc1nccc(c1)c1ccccc1
Complexity: 152
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AI53538
ChemicalName:
2-Amino-4-phenylpyridine
CasNumber:
60781-83-1
MolecularFormula:
C11H10N2
MolecularWeight:
170.2105
MdlNumber:
MFCD00137848
Smiles:
Nc1nccc(c1)c1ccccc1
Complexity:
152
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
1.8
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Smiles: S=C(n1cccc1)SCc1ccccc1
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Smiles:
S=C(n1cccc1)SCc1ccccc1
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Smiles: O=c1cc[nH]c(=O)n1C
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Smiles:
O=c1cc[nH]c(=O)n1C
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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