AE99745
153659-43-9 | 3-Fluoro-4-(pyrrolidin-1-yl)benzaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AE99745
ChemicalName
3-Fluoro-4-(pyrrolidin-1-yl)benzaldehyde
CasNumber
153659-43-9
MolecularFormula
C11H12FNO
MolecularWeight
193.2175
MdlNumber
MFCD05237677
Smiles
O=Cc1ccc(c(c1)F)N1CCCC1
Complexity
204
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
2.1
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CatalogNumber: AE99745
ChemicalName: 3-Fluoro-4-(pyrrolidin-1-yl)benzaldehyde
CasNumber: 153659-43-9
MolecularFormula: C11H12FNO
MolecularWeight: 193.2175
MdlNumber: MFCD05237677
Smiles: O=Cc1ccc(c(c1)F)N1CCCC1
Complexity: 204
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AE99745
ChemicalName:
3-Fluoro-4-(pyrrolidin-1-yl)benzaldehyde
CasNumber:
153659-43-9
MolecularFormula:
C11H12FNO
MolecularWeight:
193.2175
MdlNumber:
MFCD05237677
Smiles:
O=Cc1ccc(c(c1)F)N1CCCC1
Complexity:
204
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: AE99746
ChemicalName: 2-Piperidin-1-ylmethyl-aniline
CasNumber: 19577-83-4
MolecularFormula: C12H18N2
MolecularWeight: 190.2847
MdlNumber: MFCD04114503
Smiles: Nc1ccccc1CN1CCCCC1
Complexity: 164
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 1.9
CatalogNumber:
AE99746
ChemicalName:
2-Piperidin-1-ylmethyl-aniline
CasNumber:
19577-83-4
MolecularFormula:
C12H18N2
MolecularWeight:
190.2847
MdlNumber:
MFCD04114503
Smiles:
Nc1ccccc1CN1CCCCC1
Complexity:
164
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: Clc1cccc(c1)n1ncc(c1N)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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:
Clc1cccc(c1)n1ncc(c1N)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AE99748
ChemicalName: 1-Methyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
CasNumber: 18471-99-3
MolecularFormula: C11H9NO3
MolecularWeight: 203.19406
MdlNumber: MFCD01463245
Smiles: OC(=O)c1cn(C)c2c(c1=O)cccc2
Complexity: 335
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AE99748
ChemicalName:
1-Methyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
CasNumber:
18471-99-3
MolecularFormula:
C11H9NO3
MolecularWeight:
203.19406
MdlNumber:
MFCD01463245
Smiles:
OC(=O)c1cn(C)c2c(c1=O)cccc2
Complexity:
335
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
2