AE33261
13343-26-5 | 4-Chloro diphenyl sulfide
Manufacturer: A2B Chem
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CatalogNumber
AE33261
ChemicalName
4-Chloro diphenyl sulfide
CasNumber
13343-26-5
MolecularFormula
C12H9ClS
MolecularWeight
220.7179
MdlNumber
MFCD09038790
Smiles
Clc1ccc(cc1)Sc1ccccc1
NscNumber
50728
Complexity
158
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
1
RotatableBondCount
2
Xlogp3
5.1
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CatalogNumber: AE33261
ChemicalName: 4-Chloro diphenyl sulfide
CasNumber: 13343-26-5
MolecularFormula: C12H9ClS
MolecularWeight: 220.7179
MdlNumber: MFCD09038790
Smiles: Clc1ccc(cc1)Sc1ccccc1
NscNumber: 50728
Complexity: 158
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 1
RotatableBondCount: 2
Xlogp3: 5.1
CatalogNumber:
AE33261
ChemicalName:
4-Chloro diphenyl sulfide
CasNumber:
13343-26-5
MolecularFormula:
C12H9ClS
MolecularWeight:
220.7179
MdlNumber:
MFCD09038790
Smiles:
Clc1ccc(cc1)Sc1ccccc1
NscNumber:
50728
Complexity:
158
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
1
RotatableBondCount:
2
Xlogp3:
5.1
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Smiles: C1C(C(C(C(C1N)OC2C(C(C(C(O2)CN)O)O)O)O)OC3C(C(C(C(O3)CO)O)N)O)N.OS(=O)(=O)O
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C1C(C(C(C(C1N)OC2C(C(C(C(O2)CN)O)O)O)O)OC3C(C(C(C(O3)CO)O)N)O)N.OS(=O)(=O)O
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Smiles: Brc1ccc2c(c1)[nH]c(n2)[C@@H]1[C@H]2CC[C@@H](N1C(=O)OC(C)(C)C)C2
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Smiles:
Brc1ccc2c(c1)[nH]c(n2)[C@@H]1[C@H]2CC[C@@H](N1C(=O)OC(C)(C)C)C2
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Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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