AF29452
220461-83-6 | 4-(1H-Pyrazol-1-yl)benzoyl chloride
Manufacturer: A2B Chem
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CatalogNumber
AF29452
ChemicalName
4-(1H-Pyrazol-1-yl)benzoyl chloride
CasNumber
220461-83-6
MolecularFormula
C10H7ClN2O
MolecularWeight
206.6284
MdlNumber
MFCD02681936
Smiles
ClC(=O)c1ccc(cc1)n1cccn1
Complexity
214
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
2.7
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CatalogNumber: AF29452
ChemicalName: 4-(1H-Pyrazol-1-yl)benzoyl chloride
CasNumber: 220461-83-6
MolecularFormula: C10H7ClN2O
MolecularWeight: 206.6284
MdlNumber: MFCD02681936
Smiles: ClC(=O)c1ccc(cc1)n1cccn1
Complexity: 214
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AF29452
ChemicalName:
4-(1H-Pyrazol-1-yl)benzoyl chloride
CasNumber:
220461-83-6
MolecularFormula:
C10H7ClN2O
MolecularWeight:
206.6284
MdlNumber:
MFCD02681936
Smiles:
ClC(=O)c1ccc(cc1)n1cccn1
Complexity:
214
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
2.7
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Smiles: CC1=CC(=NC(=N1)Cl)C2=NNC(=S)N2C3=CC=C(C=C3)Cl
Complexity: __
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HydrogenBondAcceptorCount: __
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Xlogp3: __
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Smiles:
CC1=CC(=NC(=N1)Cl)C2=NNC(=S)N2C3=CC=C(C=C3)Cl
Complexity:
__
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__
HeavyAtomCount:
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Smiles: NC(=N)NS(=O)(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
Complexity: __
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Smiles:
NC(=N)NS(=O)(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
Complexity:
__
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__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: ClCC(=O)Nc1cccc(c1)C#N
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HydrogenBondAcceptorCount: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
ClCC(=O)Nc1cccc(c1)C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__