AA02804
1005584-90-6 | Methyl 4-chloro-1H-pyrazole-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA02804
ChemicalName
Methyl 4-chloro-1H-pyrazole-3-carboxylate
CasNumber
1005584-90-6
MolecularFormula
C5H5ClN2O2
MolecularWeight
160.5584
MdlNumber
MFCD04969136
Smiles
COC(=O)c1n[nH]cc1Cl
Complexity
142
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1
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CatalogNumber: AA02804
ChemicalName: Methyl 4-chloro-1H-pyrazole-3-carboxylate
CasNumber: 1005584-90-6
MolecularFormula: C5H5ClN2O2
MolecularWeight: 160.5584
MdlNumber: MFCD04969136
Smiles: COC(=O)c1n[nH]cc1Cl
Complexity: 142
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1
CatalogNumber:
AA02804
ChemicalName:
Methyl 4-chloro-1H-pyrazole-3-carboxylate
CasNumber:
1005584-90-6
MolecularFormula:
C5H5ClN2O2
MolecularWeight:
160.5584
MdlNumber:
MFCD04969136
Smiles:
COC(=O)c1n[nH]cc1Cl
Complexity:
142
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: CC(n1cc(cn1)C)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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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:
CC(n1cc(cn1)C)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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MolecularFormula: __
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Smiles: Cc1c(cnn1CC)C#N
Complexity: __
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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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:
Cc1c(cnn1CC)C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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Smiles: CCCOC(=O)c1ccc(cc1)OC(=O)c1ccccc1C(=O)Oc1ccc(cc1)C(=O)OCCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCOC(=O)c1ccc(cc1)OC(=O)c1ccccc1C(=O)Oc1ccc(cc1)C(=O)OCCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__