AA85050
163119-16-2 | 2,6-Bis-tert-butyl-4-methylcyclohexanol
Manufacturer: A2B Chem
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CatalogNumber
AA85050
ChemicalName
2,6-Bis-tert-butyl-4-methylcyclohexanol
CasNumber
163119-16-2
MolecularFormula
C15H30O
MolecularWeight
226.3981
MdlNumber
MFCD00278493
Smiles
CC1CC(C(C(C1)C(C)(C)C)O)C(C)(C)C
Complexity
207
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
2
Xlogp3
4.9
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CatalogNumber: AA85050
ChemicalName: 2,6-Bis-tert-butyl-4-methylcyclohexanol
CasNumber: 163119-16-2
MolecularFormula: C15H30O
MolecularWeight: 226.3981
MdlNumber: MFCD00278493
Smiles: CC1CC(C(C(C1)C(C)(C)C)O)C(C)(C)C
Complexity: 207
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 2
Xlogp3: 4.9
CatalogNumber:
AA85050
ChemicalName:
2,6-Bis-tert-butyl-4-methylcyclohexanol
CasNumber:
163119-16-2
MolecularFormula:
C15H30O
MolecularWeight:
226.3981
MdlNumber:
MFCD00278493
Smiles:
CC1CC(C(C(C1)C(C)(C)C)O)C(C)(C)C
Complexity:
207
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
2
Xlogp3:
4.9
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Smiles: ClCc1ccc2c(c1)C(C)(C)CCC2(C)C
Complexity: __
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Smiles:
ClCc1ccc2c(c1)C(C)(C)CCC2(C)C
Complexity:
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Smiles: O=c1[nH][nH]c(=O)n1C
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Smiles:
O=c1[nH][nH]c(=O)n1C
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Smiles: COc1cnc(c(n1)C(=O)O)N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cnc(c(n1)C(=O)O)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__