AI44611
2043-57-4 | 1,1,1,2,2,3,3,4,4,5,5,6,6-Tridecafluoro-8-iodooctane
Manufacturer: A2B Chem
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CatalogNumber
AI44611
ChemicalName
1,1,1,2,2,3,3,4,4,5,5,6,6-Tridecafluoro-8-iodooctane
CasNumber
2043-57-4
MolecularFormula
C8H4F13I
MolecularWeight
474.0011
MdlNumber
MFCD00039410
Smiles
ICCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Complexity
395
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
13
RotatableBondCount
6
Xlogp3
6.2
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CatalogNumber: AI44611
ChemicalName: 1,1,1,2,2,3,3,4,4,5,5,6,6-Tridecafluoro-8-iodooctane
CasNumber: 2043-57-4
MolecularFormula: C8H4F13I
MolecularWeight: 474.0011
MdlNumber: MFCD00039410
Smiles: ICCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Complexity: 395
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 13
RotatableBondCount: 6
Xlogp3: 6.2
CatalogNumber:
AI44611
ChemicalName:
1,1,1,2,2,3,3,4,4,5,5,6,6-Tridecafluoro-8-iodooctane
CasNumber:
2043-57-4
MolecularFormula:
C8H4F13I
MolecularWeight:
474.0011
MdlNumber:
MFCD00039410
Smiles:
ICCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Complexity:
395
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
13
RotatableBondCount:
6
Xlogp3:
6.2
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Smiles: O=S1(=O)NN=C(c2c1cccc2)c1ccccc1
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Smiles:
O=S1(=O)NN=C(c2c1cccc2)c1ccccc1
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Smiles: COC(=O)c1ncc(cc1F)B1OC(C(O1)(C)C)(C)C
Complexity: 375
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Smiles:
COC(=O)c1ncc(cc1F)B1OC(C(O1)(C)C)(C)C
Complexity:
375
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HydrogenBondAcceptorCount:
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Smiles: OB([C@@H]1C[C@H]1c1ccccc1)O
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
OB([C@@H]1C[C@H]1c1ccccc1)O
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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