AA83527
1620-98-0 | 3,5-Di-tert-butyl-4-hydroxybenzaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AA83527
ChemicalName
3,5-Di-tert-butyl-4-hydroxybenzaldehyde
CasNumber
1620-98-0
MolecularFormula
C15H22O2
MolecularWeight
234.33397999999994
MdlNumber
MFCD00008826
Smiles
O=Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C
NscNumber
14450
Complexity
246
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
4.4
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CatalogNumber: AA83527
ChemicalName: 3,5-Di-tert-butyl-4-hydroxybenzaldehyde
CasNumber: 1620-98-0
MolecularFormula: C15H22O2
MolecularWeight: 234.33397999999994
MdlNumber: MFCD00008826
Smiles: O=Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C
NscNumber: 14450
Complexity: 246
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 4.4
CatalogNumber:
AA83527
ChemicalName:
3,5-Di-tert-butyl-4-hydroxybenzaldehyde
CasNumber:
1620-98-0
MolecularFormula:
C15H22O2
MolecularWeight:
234.33397999999994
MdlNumber:
MFCD00008826
Smiles:
O=Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C
NscNumber:
14450
Complexity:
246
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
4.4
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Smiles: CC(c1cc(CSCc2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)cc(c1O)C(C)(C)C)(C)C
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Smiles:
CC(c1cc(CSCc2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)cc(c1O)C(C)(C)C)(C)C
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Smiles: FC(c1nccc(c1)C)(F)F
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Smiles:
FC(c1nccc(c1)C)(F)F
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Cc1cccnc1C(F)(F)F
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
Cc1cccnc1C(F)(F)F
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__