AF59181
42288-08-4 | 3-Methyl-3-(4-methylphenyl)butanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AF59181
ChemicalName
3-Methyl-3-(4-methylphenyl)butanoic acid
CasNumber
42288-08-4
MolecularFormula
C12H16O2
MolecularWeight
192.25423999999998
MdlNumber
MFCD03844683
Smiles
OC(=O)CC(c1ccc(cc1)C)(C)C
Complexity
200
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.9
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CatalogNumber: AF59181
ChemicalName: 3-Methyl-3-(4-methylphenyl)butanoic acid
CasNumber: 42288-08-4
MolecularFormula: C12H16O2
MolecularWeight: 192.25423999999998
MdlNumber: MFCD03844683
Smiles: OC(=O)CC(c1ccc(cc1)C)(C)C
Complexity: 200
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.9
CatalogNumber:
AF59181
ChemicalName:
3-Methyl-3-(4-methylphenyl)butanoic acid
CasNumber:
42288-08-4
MolecularFormula:
C12H16O2
MolecularWeight:
192.25423999999998
MdlNumber:
MFCD03844683
Smiles:
OC(=O)CC(c1ccc(cc1)C)(C)C
Complexity:
200
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.9
CatalogNumber: AF59182
ChemicalName: 4-(4-Fluorophenyl)piperidin-4-ol
CasNumber: 3888-65-1
MolecularFormula: C11H14FNO
MolecularWeight: 195.2334
MdlNumber: MFCD00023146
Smiles: OC1(CCNCC1)c1ccc(cc1)F
Complexity: 184
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.1
CatalogNumber:
AF59182
ChemicalName:
4-(4-Fluorophenyl)piperidin-4-ol
CasNumber:
3888-65-1
MolecularFormula:
C11H14FNO
MolecularWeight:
195.2334
MdlNumber:
MFCD00023146
Smiles:
OC1(CCNCC1)c1ccc(cc1)F
Complexity:
184
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.1
CatalogNumber: AF59183
ChemicalName: 1,2,3,4-Tetrahydronaphthalen-1-one oxime
CasNumber: 3349-64-2
MolecularFormula: C10H11NO
MolecularWeight: 161.2004
MdlNumber: MFCD00029228
Smiles: ON=C1CCCc2c1cccc2
Complexity: 188
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
AF59183
ChemicalName:
1,2,3,4-Tetrahydronaphthalen-1-one oxime
CasNumber:
3349-64-2
MolecularFormula:
C10H11NO
MolecularWeight:
161.2004
MdlNumber:
MFCD00029228
Smiles:
ON=C1CCCc2c1cccc2
Complexity:
188
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCCN1CC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCCN1CC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__