AB46964
2435-50-9 | Pyrimidine-4-carboxaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AB46964
ChemicalName
Pyrimidine-4-carboxaldehyde
CasNumber
2435-50-9
MolecularFormula
C5H4N2O
MolecularWeight
108.0981
MdlNumber
MFCD03789624
Smiles
O=Cc1ccncn1
Complexity
84.5
Covalently-bondedUnitCount
1
HeavyAtomCount
8
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
-0.7
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CatalogNumber: AB46964
ChemicalName: Pyrimidine-4-carboxaldehyde
CasNumber: 2435-50-9
MolecularFormula: C5H4N2O
MolecularWeight: 108.0981
MdlNumber: MFCD03789624
Smiles: O=Cc1ccncn1
Complexity: 84.5
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: -0.7
CatalogNumber:
AB46964
ChemicalName:
Pyrimidine-4-carboxaldehyde
CasNumber:
2435-50-9
MolecularFormula:
C5H4N2O
MolecularWeight:
108.0981
MdlNumber:
MFCD03789624
Smiles:
O=Cc1ccncn1
Complexity:
84.5
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
-0.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: c1ccc[nH]1
Complexity: 22.8
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 0.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
c1ccc[nH]1
Complexity:
22.8
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
0.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CCn1cccc1
Complexity: 119
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 0.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CCn1cccc1
Complexity:
119
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1ccc[nH]1
Complexity: 103
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 0.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1ccc[nH]1
Complexity:
103
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
0.8