AB69526
2725-53-3 | 5-tert-Butylsalicylaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AB69526
ChemicalName
5-tert-Butylsalicylaldehyde
CasNumber
2725-53-3
MolecularFormula
C11H14O2
MolecularWeight
178.2277
MdlNumber
MFCD01321335
Smiles
O=Cc1cc(ccc1O)C(C)(C)C
Complexity
181
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3.3
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CatalogNumber: AB69526
ChemicalName: 5-tert-Butylsalicylaldehyde
CasNumber: 2725-53-3
MolecularFormula: C11H14O2
MolecularWeight: 178.2277
MdlNumber: MFCD01321335
Smiles: O=Cc1cc(ccc1O)C(C)(C)C
Complexity: 181
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.3
CatalogNumber:
AB69526
ChemicalName:
5-tert-Butylsalicylaldehyde
CasNumber:
2725-53-3
MolecularFormula:
C11H14O2
MolecularWeight:
178.2277
MdlNumber:
MFCD01321335
Smiles:
O=Cc1cc(ccc1O)C(C)(C)C
Complexity:
181
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.3
CatalogNumber: AB69527
ChemicalName: 5-tert-Butyl-2-methoxybenzoic acid
CasNumber: 73469-54-2
MolecularFormula: C12H16O3
MolecularWeight: 208.2536
MdlNumber: MFCD02093964
Smiles: COc1ccc(cc1C(=O)O)C(C)(C)C
Complexity: 230
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.3
CatalogNumber:
AB69527
ChemicalName:
5-tert-Butyl-2-methoxybenzoic acid
CasNumber:
73469-54-2
MolecularFormula:
C12H16O3
MolecularWeight:
208.2536
MdlNumber:
MFCD02093964
Smiles:
COc1ccc(cc1C(=O)O)C(C)(C)C
Complexity:
230
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.3
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Smiles: O=C=Nc1cc(ccc1OC)C(C)(C)C
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Smiles:
O=C=Nc1cc(ccc1OC)C(C)(C)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: OC(=O)c1cc(oc1C)C(C)(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cc(oc1C)C(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__