AI54277
640769-71-7 | 2-(5-Pyrimidinyl)benzaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AI54277
ChemicalName
2-(5-Pyrimidinyl)benzaldehyde
CasNumber
640769-71-7
MolecularFormula
C11H8N2O
MolecularWeight
184.194
MdlNumber
MFCD02684096
Smiles
O=Cc1ccccc1c1cncnc1
Complexity
190
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
1.3
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CatalogNumber: AI54277
ChemicalName: 2-(5-Pyrimidinyl)benzaldehyde
CasNumber: 640769-71-7
MolecularFormula: C11H8N2O
MolecularWeight: 184.194
MdlNumber: MFCD02684096
Smiles: O=Cc1ccccc1c1cncnc1
Complexity: 190
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.3
CatalogNumber:
AI54277
ChemicalName:
2-(5-Pyrimidinyl)benzaldehyde
CasNumber:
640769-71-7
MolecularFormula:
C11H8N2O
MolecularWeight:
184.194
MdlNumber:
MFCD02684096
Smiles:
O=Cc1ccccc1c1cncnc1
Complexity:
190
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.3
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Smiles: O=C1c2ccccc2C(=O)c2c1c(O)c(c(c2N)O)S(=O)(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
O=C1c2ccccc2C(=O)c2c1c(O)c(c(c2N)O)S(=O)(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: O=C(c1cc2ccccc2c(c1O)N=Nc1ccccc1Cl)Nc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(c1cc2ccccc2c(c1O)N=Nc1ccccc1Cl)Nc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#Cc1cc(C)ccc1c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1cc(C)ccc1c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__