AA11614
1136-76-1 | 5-Methyl-2-phenylpyrazole-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA11614
ChemicalName
5-Methyl-2-phenylpyrazole-3-carboxylic acid
CasNumber
1136-76-1
MolecularFormula
C11H10N2O2
MolecularWeight
202.2093
MdlNumber
MFCD01693509
Smiles
Cc1nn(c(c1)C(=O)O)c1ccccc1
Complexity
239
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.2
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CatalogNumber: AA11614
ChemicalName: 5-Methyl-2-phenylpyrazole-3-carboxylic acid
CasNumber: 1136-76-1
MolecularFormula: C11H10N2O2
MolecularWeight: 202.2093
MdlNumber: MFCD01693509
Smiles: Cc1nn(c(c1)C(=O)O)c1ccccc1
Complexity: 239
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.2
CatalogNumber:
AA11614
ChemicalName:
5-Methyl-2-phenylpyrazole-3-carboxylic acid
CasNumber:
1136-76-1
MolecularFormula:
C11H10N2O2
MolecularWeight:
202.2093
MdlNumber:
MFCD01693509
Smiles:
Cc1nn(c(c1)C(=O)O)c1ccccc1
Complexity:
239
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: COC(=O)C1CNc2c(C1=O)cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COC(=O)C1CNc2c(C1=O)cccc2
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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MolecularFormula: __
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Smiles: OCc1c(C)nn(c1Cl)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
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:
OCc1c(C)nn(c1Cl)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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ChemicalName: __
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MolecularFormula: __
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Smiles: OCc1cnc(c2c1COC(O2)(C)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCc1cnc(c2c1COC(O2)(C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__