AB40976
306936-57-2 | 5-(4-Fluorophenyl)-1H-pyrazole-4-carbaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AB40976
ChemicalName
5-(4-Fluorophenyl)-1H-pyrazole-4-carbaldehyde
CasNumber
306936-57-2
MolecularFormula
C10H7FN2O
MolecularWeight
190.1738
MdlNumber
MFCD09865752
Smiles
O=Cc1c[nH]nc1c1ccc(cc1)F
Complexity
204
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.4
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CatalogNumber: AB40976
ChemicalName: 5-(4-Fluorophenyl)-1H-pyrazole-4-carbaldehyde
CasNumber: 306936-57-2
MolecularFormula: C10H7FN2O
MolecularWeight: 190.1738
MdlNumber: MFCD09865752
Smiles: O=Cc1c[nH]nc1c1ccc(cc1)F
Complexity: 204
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.4
CatalogNumber:
AB40976
ChemicalName:
5-(4-Fluorophenyl)-1H-pyrazole-4-carbaldehyde
CasNumber:
306936-57-2
MolecularFormula:
C10H7FN2O
MolecularWeight:
190.1738
MdlNumber:
MFCD09865752
Smiles:
O=Cc1c[nH]nc1c1ccc(cc1)F
Complexity:
204
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.4
CatalogNumber: AB40977
ChemicalName: Methyl 5-(chlorosulfonyl)-1-methyl-1H-pyrrole-2-carboxylate
CasNumber: 306936-53-8
MolecularFormula: C7H8ClNO4S
MolecularWeight: 237.6607
MdlNumber: MFCD02180789
Smiles: COC(=O)c1ccc(n1C)S(=O)(=O)Cl
Complexity: 323
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 1.2
CatalogNumber:
AB40977
ChemicalName:
Methyl 5-(chlorosulfonyl)-1-methyl-1H-pyrrole-2-carboxylate
CasNumber:
306936-53-8
MolecularFormula:
C7H8ClNO4S
MolecularWeight:
237.6607
MdlNumber:
MFCD02180789
Smiles:
COC(=O)c1ccc(n1C)S(=O)(=O)Cl
Complexity:
323
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
1.2
CatalogNumber: AB40978
ChemicalName: Methyl 2-(aminomethyl)furan-3-carboxylate
CasNumber: 306936-50-5
MolecularFormula: C7H9NO3
MolecularWeight: 155.1513
MdlNumber: MFCD02677689
Smiles: COC(=O)c1ccoc1CN
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: -0.3
CatalogNumber:
AB40978
ChemicalName:
Methyl 2-(aminomethyl)furan-3-carboxylate
CasNumber:
306936-50-5
MolecularFormula:
C7H9NO3
MolecularWeight:
155.1513
MdlNumber:
MFCD02677689
Smiles:
COC(=O)c1ccoc1CN
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
-0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1sccc1c1nc2c(s1)cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1sccc1c1nc2c(s1)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__