AA98438
18274-81-2 | 5-(4-Hydroxyphenyl)-3h-1,2-dithiole-3-thione
Manufacturer: A2B Chem
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CatalogNumber
AA98438
ChemicalName
5-(4-Hydroxyphenyl)-3h-1,2-dithiole-3-thione
CasNumber
18274-81-2
MolecularFormula
C9H6OS3
MolecularWeight
226.3383
MdlNumber
MFCD20922704
Smiles
Oc1ccc(cc1)c1ssc(=S)c1
Complexity
241
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.4
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CatalogNumber: AA98438
ChemicalName: 5-(4-Hydroxyphenyl)-3h-1,2-dithiole-3-thione
CasNumber: 18274-81-2
MolecularFormula: C9H6OS3
MolecularWeight: 226.3383
MdlNumber: MFCD20922704
Smiles: Oc1ccc(cc1)c1ssc(=S)c1
Complexity: 241
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.4
CatalogNumber:
AA98438
ChemicalName:
5-(4-Hydroxyphenyl)-3h-1,2-dithiole-3-thione
CasNumber:
18274-81-2
MolecularFormula:
C9H6OS3
MolecularWeight:
226.3383
MdlNumber:
MFCD20922704
Smiles:
Oc1ccc(cc1)c1ssc(=S)c1
Complexity:
241
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: OC(=O)CCC1=C(CC(=O)O)C2=Cc3[nH]c(c(c3CCC(=O)O)CC(=O)O)C=C3N=C(C=c4[nH]c(=CC1=N2)c(CC(=O)O)c4CCC(=O)O)C(=C3CC(=O)O)CCC(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
OC(=O)CCC1=C(CC(=O)O)C2=Cc3[nH]c(c(c3CCC(=O)O)CC(=O)O)C=C3N=C(C=c4[nH]c(=CC1=N2)c(CC(=O)O)c4CCC(=O)O)C(=C3CC(=O)O)CCC(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOc1ccc(cc1)CCC(=C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
CCOc1ccc(cc1)CCC(=C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOc1ccccc1CCC(=C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCOc1ccccc1CCC(=C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__