AH94235
89640-03-9 | Ethyl 5-chloro-4-nitrothiophene-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AH94235
ChemicalName
Ethyl 5-chloro-4-nitrothiophene-2-carboxylate
CasNumber
89640-03-9
MolecularFormula
C7H6ClNO4S
MolecularWeight
235.6448
MdlNumber
MFCD12974868
Smiles
CCOC(=O)c1sc(c(c1)[N+](=O)[O-])Cl
Complexity
244
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
RotatableBondCount
3
Xlogp3
2.9
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CatalogNumber: AH94235
ChemicalName: Ethyl 5-chloro-4-nitrothiophene-2-carboxylate
CasNumber: 89640-03-9
MolecularFormula: C7H6ClNO4S
MolecularWeight: 235.6448
MdlNumber: MFCD12974868
Smiles: CCOC(=O)c1sc(c(c1)[N+](=O)[O-])Cl
Complexity: 244
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 2.9
CatalogNumber:
AH94235
ChemicalName:
Ethyl 5-chloro-4-nitrothiophene-2-carboxylate
CasNumber:
89640-03-9
MolecularFormula:
C7H6ClNO4S
MolecularWeight:
235.6448
MdlNumber:
MFCD12974868
Smiles:
CCOC(=O)c1sc(c(c1)[N+](=O)[O-])Cl
Complexity:
244
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: CC(=O)C1=CC=CC=C1C(C(=O)O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CC(=O)C1=CC=CC=C1C(C(=O)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
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__
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ChemicalName: __
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MolecularFormula: __
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Smiles: NC(=O)[C@@H]1CCCN(C1)C(=O)OC(C)(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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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:
NC(=O)[C@@H]1CCCN(C1)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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Smiles: Fc1ccc(nc1)[C@@H](N)C
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
Fc1ccc(nc1)[C@@H](N)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__