AD35330
39846-84-9 | Ethyl 5-nitro-1h-pyrazole-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AD35330
ChemicalName
Ethyl 5-nitro-1h-pyrazole-3-carboxylate
CasNumber
39846-84-9
MolecularFormula
C6H7N3O4
MolecularWeight
185.1375
MdlNumber
MFCD04971172
Smiles
[O-][N+](=O)c1cc(n[nH]1)C(=O)OCC
Complexity
214
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.9
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CatalogNumber: AD35330
ChemicalName: Ethyl 5-nitro-1h-pyrazole-3-carboxylate
CasNumber: 39846-84-9
MolecularFormula: C6H7N3O4
MolecularWeight: 185.1375
MdlNumber: MFCD04971172
Smiles: [O-][N+](=O)c1cc(n[nH]1)C(=O)OCC
Complexity: 214
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.9
CatalogNumber:
AD35330
ChemicalName:
Ethyl 5-nitro-1h-pyrazole-3-carboxylate
CasNumber:
39846-84-9
MolecularFormula:
C6H7N3O4
MolecularWeight:
185.1375
MdlNumber:
MFCD04971172
Smiles:
[O-][N+](=O)c1cc(n[nH]1)C(=O)OCC
Complexity:
214
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: COc1ccc(c(c1)F)S
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
COc1ccc(c(c1)F)S
Complexity:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: C=C1COCCO1
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Smiles:
C=C1COCCO1
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: CCCCCCCCCCCCCCCCCC(=O)OCCN(C)C
Complexity: __
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MolecularFormula:
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Smiles:
CCCCCCCCCCCCCCCCCC(=O)OCCN(C)C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
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