AB56608
22317-34-6 | 3-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)propan-1-one
Manufacturer: A2B Chem
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CatalogNumber
AB56608
ChemicalName
3-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)propan-1-one
CasNumber
22317-34-6
MolecularFormula
C17H18O6
MolecularWeight
318.3212
MdlNumber
MFCD23160693
Smiles
OCC(C(=O)c1ccc(c(c1)OC)O)Oc1ccccc1OC
NscNumber
641529
Complexity
374
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
7
UndefinedAtomStereocenterCount
1
Xlogp3
2.2
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CatalogNumber: AB56608
ChemicalName: 3-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)propan-1-one
CasNumber: 22317-34-6
MolecularFormula: C17H18O6
MolecularWeight: 318.3212
MdlNumber: MFCD23160693
Smiles: OCC(C(=O)c1ccc(c(c1)OC)O)Oc1ccccc1OC
NscNumber: 641529
Complexity: 374
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 7
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.2
CatalogNumber:
AB56608
ChemicalName:
3-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)propan-1-one
CasNumber:
22317-34-6
MolecularFormula:
C17H18O6
MolecularWeight:
318.3212
MdlNumber:
MFCD23160693
Smiles:
OCC(C(=O)c1ccc(c(c1)OC)O)Oc1ccccc1OC
NscNumber:
641529
Complexity:
374
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
7
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.2
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Smiles: Oc1ccc(cc1)CN1CCNCC1
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Oc1ccc(cc1)CN1CCNCC1
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Smiles: Oc1ccc(cc1)n1nn[nH]c1=S
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Smiles:
Oc1ccc(cc1)n1nn[nH]c1=S
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HeavyAtomCount:
__
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__
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__
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Smiles: NC(=S)Nc1ccc(cc1)O
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Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC(=S)Nc1ccc(cc1)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__