AI09016
1125-29-7 | 1,3,5-Trimethyl-1h-pyrazole-4-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AI09016
ChemicalName
1,3,5-Trimethyl-1h-pyrazole-4-carboxylic acid
CasNumber
1125-29-7
MolecularFormula
C7H10N2O2
MolecularWeight
154.1665
MdlNumber
MFCD00159648
Smiles
OC(=O)c1c(C)nn(c1C)C
Complexity
172
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.6
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CatalogNumber: AI09016
ChemicalName: 1,3,5-Trimethyl-1h-pyrazole-4-carboxylic acid
CasNumber: 1125-29-7
MolecularFormula: C7H10N2O2
MolecularWeight: 154.1665
MdlNumber: MFCD00159648
Smiles: OC(=O)c1c(C)nn(c1C)C
Complexity: 172
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.6
CatalogNumber:
AI09016
ChemicalName:
1,3,5-Trimethyl-1h-pyrazole-4-carboxylic acid
CasNumber:
1125-29-7
MolecularFormula:
C7H10N2O2
MolecularWeight:
154.1665
MdlNumber:
MFCD00159648
Smiles:
OC(=O)c1c(C)nn(c1C)C
Complexity:
172
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1ccc2c(c1)c(C)co2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularWeight:
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Smiles:
Clc1ccc2c(c1)c(C)co2
Complexity:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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__
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MolecularFormula: __
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Smiles: Brc1scc(n1)c1cccs1
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Smiles:
Brc1scc(n1)c1cccs1
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Oc1cccc(n1)c1ccc(cc1)S(=O)(=O)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Oc1cccc(n1)c1ccc(cc1)S(=O)(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__