AG25569
53173-70-9 | 3-(Difluoromethoxy)-4-hydroxybenzaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AG25569
ChemicalName
3-(Difluoromethoxy)-4-hydroxybenzaldehyde
CasNumber
53173-70-9
MolecularFormula
C8H6F2O3
MolecularWeight
188.1282
MdlNumber
MFCD00720656
Smiles
O=Cc1ccc(c(c1)OC(F)F)O
Complexity
175
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.2
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CatalogNumber: AG25569
ChemicalName: 3-(Difluoromethoxy)-4-hydroxybenzaldehyde
CasNumber: 53173-70-9
MolecularFormula: C8H6F2O3
MolecularWeight: 188.1282
MdlNumber: MFCD00720656
Smiles: O=Cc1ccc(c(c1)OC(F)F)O
Complexity: 175
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.2
CatalogNumber:
AG25569
ChemicalName:
3-(Difluoromethoxy)-4-hydroxybenzaldehyde
CasNumber:
53173-70-9
MolecularFormula:
C8H6F2O3
MolecularWeight:
188.1282
MdlNumber:
MFCD00720656
Smiles:
O=Cc1ccc(c(c1)OC(F)F)O
Complexity:
175
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.2
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Smiles: [2H]c1[nH]nc(c1[2H])[2H]
Complexity: __
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HeavyAtomCount: __
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HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
[2H]c1[nH]nc(c1[2H])[2H]
Complexity:
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HydrogenBondAcceptorCount:
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Smiles: O=C1OP(=O)(Cl)Oc2c1cccc2
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Smiles:
O=C1OP(=O)(Cl)Oc2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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__
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Smiles: ClCCN(c1cccc(c1)Cl)CCCl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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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:
ClCCN(c1cccc(c1)Cl)CCCl
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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