AH49858
84547-93-3 | 4-Bromo-3-nitro-1H-pyrazole-5-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AH49858
ChemicalName
4-Bromo-3-nitro-1H-pyrazole-5-carboxylic acid
CasNumber
84547-93-3
MolecularFormula
C4H2BrN3O4
MolecularWeight
235.9804
MdlNumber
MFCD00464256
Smiles
[O-][N+](=O)c1[nH]nc(c1Br)C(=O)O
Complexity
217
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
0.9
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CatalogNumber: AH49858
ChemicalName: 4-Bromo-3-nitro-1H-pyrazole-5-carboxylic acid
CasNumber: 84547-93-3
MolecularFormula: C4H2BrN3O4
MolecularWeight: 235.9804
MdlNumber: MFCD00464256
Smiles: [O-][N+](=O)c1[nH]nc(c1Br)C(=O)O
Complexity: 217
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 0.9
CatalogNumber:
AH49858
ChemicalName:
4-Bromo-3-nitro-1H-pyrazole-5-carboxylic acid
CasNumber:
84547-93-3
MolecularFormula:
C4H2BrN3O4
MolecularWeight:
235.9804
MdlNumber:
MFCD00464256
Smiles:
[O-][N+](=O)c1[nH]nc(c1Br)C(=O)O
Complexity:
217
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
0.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: CCn1c(S)nnc1C1CC1c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
__
CasNumber:
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MolecularFormula:
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Smiles:
CCn1c(S)nnc1C1CC1c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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__
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ChemicalName: __
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MolecularFormula: __
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Smiles: Cc1nc2cc(nn2c(c1)c1ccccc1)C(=O)O
Complexity: __
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Xlogp3: __
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MolecularFormula:
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Smiles:
Cc1nc2cc(nn2c(c1)c1ccccc1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: FC(c1cc(C2CC2)c2c(n1)[nH]nc2N)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
FC(c1cc(C2CC2)c2c(n1)[nH]nc2N)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__