AA33530
120-44-5 | Desoxyanisoin
Manufacturer: A2B Chem
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CatalogNumber
AA33530
ChemicalName
Desoxyanisoin
CasNumber
120-44-5
MolecularFormula
C16H16O3
MolecularWeight
256.2964
MdlNumber
MFCD00008406
Smiles
COc1ccc(cc1)CC(=O)c1ccc(cc1)OC
Complexity
274
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
3
RotatableBondCount
5
Xlogp3
3.1
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CatalogNumber: AA33530
ChemicalName: Desoxyanisoin
CasNumber: 120-44-5
MolecularFormula: C16H16O3
MolecularWeight: 256.2964
MdlNumber: MFCD00008406
Smiles: COc1ccc(cc1)CC(=O)c1ccc(cc1)OC
Complexity: 274
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
RotatableBondCount: 5
Xlogp3: 3.1
CatalogNumber:
AA33530
ChemicalName:
Desoxyanisoin
CasNumber:
120-44-5
MolecularFormula:
C16H16O3
MolecularWeight:
256.2964
MdlNumber:
MFCD00008406
Smiles:
COc1ccc(cc1)CC(=O)c1ccc(cc1)OC
Complexity:
274
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
RotatableBondCount:
5
Xlogp3:
3.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)N1CCNCC1
Complexity: 132
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: -0.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)N1CCNCC1
Complexity:
132
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
-0.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCOC(=O)COc1cc(Cl)c(cc1Cl)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCOC(=O)COc1cc(Cl)c(cc1Cl)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA33533
ChemicalName: 3-Ethylamino-4-methylphenol
CasNumber: 120-37-6
MolecularFormula: C9H13NO
MolecularWeight: 151.2056
MdlNumber: MFCD00002382
Smiles: Cc1ccc(cc1NCC)O
Complexity: 116
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 2.3
CatalogNumber:
AA33533
ChemicalName:
3-Ethylamino-4-methylphenol
CasNumber:
120-37-6
MolecularFormula:
C9H13NO
MolecularWeight:
151.2056
MdlNumber:
MFCD00002382
Smiles:
Cc1ccc(cc1NCC)O
Complexity:
116
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
2.3