AB39878
30431-54-0 | Bis[3,4,6-trichloro-2-(pentyloxycarbonyl)phenyl] oxalate
Manufacturer: A2B Chem
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CatalogNumber
AB39878
ChemicalName
Bis[3,4,6-trichloro-2-(pentyloxycarbonyl)phenyl] oxalate
CasNumber
30431-54-0
MolecularFormula
C26H24Cl6O8
MolecularWeight
677.1819599999999
MdlNumber
MFCD00191674
Smiles
CCCCCOC(=O)c1c(OC(=O)C(=O)Oc2c(Cl)cc(c(c2C(=O)OCCCCC)Cl)Cl)c(Cl)cc(c1Cl)Cl
Complexity
795
Covalently-bondedUnitCount
1
HeavyAtomCount
40
HydrogenBondAcceptorCount
8
RotatableBondCount
17
Xlogp3
10.6
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CatalogNumber: AB39878
ChemicalName: Bis[3,4,6-trichloro-2-(pentyloxycarbonyl)phenyl] oxalate
CasNumber: 30431-54-0
MolecularFormula: C26H24Cl6O8
MolecularWeight: 677.1819599999999
MdlNumber: MFCD00191674
Smiles: CCCCCOC(=O)c1c(OC(=O)C(=O)Oc2c(Cl)cc(c(c2C(=O)OCCCCC)Cl)Cl)c(Cl)cc(c1Cl)Cl
Complexity: 795
Covalently-bondedUnitCount: 1
HeavyAtomCount: 40
HydrogenBondAcceptorCount: 8
RotatableBondCount: 17
Xlogp3: 10.6
CatalogNumber:
AB39878
ChemicalName:
Bis[3,4,6-trichloro-2-(pentyloxycarbonyl)phenyl] oxalate
CasNumber:
30431-54-0
MolecularFormula:
C26H24Cl6O8
MolecularWeight:
677.1819599999999
MdlNumber:
MFCD00191674
Smiles:
CCCCCOC(=O)c1c(OC(=O)C(=O)Oc2c(Cl)cc(c(c2C(=O)OCCCCC)Cl)Cl)c(Cl)cc(c1Cl)Cl
Complexity:
795
Covalently-bondedUnitCount:
1
HeavyAtomCount:
40
HydrogenBondAcceptorCount:
8
RotatableBondCount:
17
Xlogp3:
10.6
CatalogNumber: __
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Smiles: CCCCCOC(=O)c1c(O)c(Cl)cc(c1Cl)Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
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Smiles:
CCCCCOC(=O)c1c(O)c(Cl)cc(c1Cl)Cl
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CCCCC=CC(C(Br)(F)F)(Cl)F
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Smiles:
CCCCC=CC(C(Br)(F)F)(Cl)F
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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Smiles: CCCCC(CC(C(Br)(F)F)(Cl)F)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCCCC(CC(C(Br)(F)F)(Cl)F)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__