AI63709
948570-75-0 | 1-(2-Methoxyethyl)-4-nitropyrazole
Manufacturer: A2B Chem
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CatalogNumber
AI63709
ChemicalName
1-(2-Methoxyethyl)-4-nitropyrazole
CasNumber
948570-75-0
MolecularFormula
C6H9N3O3
MolecularWeight
171.154
MdlNumber
MFCD02755678
Smiles
[O-][N+](=O)c1cn(nc1)CCOC
Complexity
159
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
-0.2
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CatalogNumber: AI63709
ChemicalName: 1-(2-Methoxyethyl)-4-nitropyrazole
CasNumber: 948570-75-0
MolecularFormula: C6H9N3O3
MolecularWeight: 171.154
MdlNumber: MFCD02755678
Smiles: [O-][N+](=O)c1cn(nc1)CCOC
Complexity: 159
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: -0.2
CatalogNumber:
AI63709
ChemicalName:
1-(2-Methoxyethyl)-4-nitropyrazole
CasNumber:
948570-75-0
MolecularFormula:
C6H9N3O3
MolecularWeight:
171.154
MdlNumber:
MFCD02755678
Smiles:
[O-][N+](=O)c1cn(nc1)CCOC
Complexity:
159
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
-0.2
CatalogNumber: AI63710
ChemicalName: Methyl 4-oxo-1,4-dihydroquinoline-6-carboxylate
CasNumber: 948571-56-0
MolecularFormula: C11H9NO3
MolecularWeight: 203.1941
MdlNumber: MFCD19105059
Smiles: COC(=O)c1ccc2c(c1)c(=O)cc[nH]2
Complexity: 311
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 0.4
CatalogNumber:
AI63710
ChemicalName:
Methyl 4-oxo-1,4-dihydroquinoline-6-carboxylate
CasNumber:
948571-56-0
MolecularFormula:
C11H9NO3
MolecularWeight:
203.1941
MdlNumber:
MFCD19105059
Smiles:
COC(=O)c1ccc2c(c1)c(=O)cc[nH]2
Complexity:
311
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CNc1cnn(c1)C
Complexity: 74.1
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 0.2
CatalogNumber:
__
ChemicalName:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CNc1cnn(c1)C
Complexity:
74.1
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
0.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#Cc1cnn2c1nc(S)nc2O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
N#Cc1cnn2c1nc(S)nc2O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__