AI00566
90178-72-6 | 4-(3-Formylphenoxy)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AI00566
ChemicalName
4-(3-Formylphenoxy)benzonitrile
CasNumber
90178-72-6
MolecularFormula
C14H9NO2
MolecularWeight
223.2268
MdlNumber
MFCD11500847
Smiles
O=Cc1cccc(c1)Oc1ccc(cc1)C#N
Complexity
299
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
3.1
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CatalogNumber: AI00566
ChemicalName: 4-(3-Formylphenoxy)benzonitrile
CasNumber: 90178-72-6
MolecularFormula: C14H9NO2
MolecularWeight: 223.2268
MdlNumber: MFCD11500847
Smiles: O=Cc1cccc(c1)Oc1ccc(cc1)C#N
Complexity: 299
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 3.1
CatalogNumber:
AI00566
ChemicalName:
4-(3-Formylphenoxy)benzonitrile
CasNumber:
90178-72-6
MolecularFormula:
C14H9NO2
MolecularWeight:
223.2268
MdlNumber:
MFCD11500847
Smiles:
O=Cc1cccc(c1)Oc1ccc(cc1)C#N
Complexity:
299
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
3.1
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MolecularFormula: __
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Smiles: C#CCS(=O)(=O)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
C#CCS(=O)(=O)O
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: OC(=O)C1CC(C(=O)O)C(CC1C)C(=O)O
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Smiles:
OC(=O)C1CC(C(=O)O)C(CC1C)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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Smiles: O=S1(=O)CC2C(C1)NC(O2)C(Cl)(Cl)Cl
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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:
O=S1(=O)CC2C(C1)NC(O2)C(Cl)(Cl)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__