AB85169
89532-43-4 | 3-(1H-Pyrazol-1-yl)propanal
Manufacturer: A2B Chem
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CatalogNumber
AB85169
ChemicalName
3-(1H-Pyrazol-1-yl)propanal
CasNumber
89532-43-4
MolecularFormula
C6H8N2O
MolecularWeight
124.1405
MdlNumber
MFCD03727243
Smiles
O=CCCn1cccn1
Complexity
95.1
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
2
RotatableBondCount
3
Xlogp3
-1
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CatalogNumber: AB85169
ChemicalName: 3-(1H-Pyrazol-1-yl)propanal
CasNumber: 89532-43-4
MolecularFormula: C6H8N2O
MolecularWeight: 124.1405
MdlNumber: MFCD03727243
Smiles: O=CCCn1cccn1
Complexity: 95.1
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: -1
CatalogNumber:
AB85169
ChemicalName:
3-(1H-Pyrazol-1-yl)propanal
CasNumber:
89532-43-4
MolecularFormula:
C6H8N2O
MolecularWeight:
124.1405
MdlNumber:
MFCD03727243
Smiles:
O=CCCn1cccn1
Complexity:
95.1
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
-1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CN(C=O)CC(=O)OCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CN(C=O)CC(=O)OCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CN1CCOCC1.Cl
Complexity: 120
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CN1CCOCC1.Cl
Complexity:
120
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cccc2c1oc(c2O)C#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cccc2c1oc(c2O)C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__