AB63608
52479-85-3 | 2,3,3',4,4',5'-Hexahydroxybenzophenone
Manufacturer: A2B Chem
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CatalogNumber
AB63608
ChemicalName
2,3,3',4,4',5'-Hexahydroxybenzophenone
CasNumber
52479-85-3
MolecularFormula
C13H10O7
MolecularWeight
278.2143
MdlNumber
MFCD00082966
Smiles
O=C(c1ccc(c(c1O)O)O)c1cc(O)c(c(c1)O)O
NscNumber
680919
Complexity
349
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
6
RotatableBondCount
2
Xlogp3
1.7
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CatalogNumber: AB63608
ChemicalName: 2,3,3',4,4',5'-Hexahydroxybenzophenone
CasNumber: 52479-85-3
MolecularFormula: C13H10O7
MolecularWeight: 278.2143
MdlNumber: MFCD00082966
Smiles: O=C(c1ccc(c(c1O)O)O)c1cc(O)c(c(c1)O)O
NscNumber: 680919
Complexity: 349
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 6
RotatableBondCount: 2
Xlogp3: 1.7
CatalogNumber:
AB63608
ChemicalName:
2,3,3',4,4',5'-Hexahydroxybenzophenone
CasNumber:
52479-85-3
MolecularFormula:
C13H10O7
MolecularWeight:
278.2143
MdlNumber:
MFCD00082966
Smiles:
O=C(c1ccc(c(c1O)O)O)c1cc(O)c(c(c1)O)O
NscNumber:
680919
Complexity:
349
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
6
RotatableBondCount:
2
Xlogp3:
1.7
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Smiles: Oc1c(C)c(Br)c(c(c1Br)Br)Br
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Smiles:
Oc1c(C)c(Br)c(c(c1Br)Br)Br
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Smiles: Oc1ccc2c(c1)Oc1c(C32OC(=O)c2c3c(Cl)c(Cl)c(c2Cl)Cl)ccc(c1)O
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Smiles:
Oc1ccc2c(c1)Oc1c(C32OC(=O)c2c3c(Cl)c(Cl)c(c2Cl)Cl)ccc(c1)O
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Complexity:
__
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HydrogenBondDonorCount:
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RotatableBondCount:
__
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__
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Smiles: COc1cc(OC)c2c(c1)oc(cc2=O)c1ccc(c(c1)OC)OC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(OC)c2c(c1)oc(cc2=O)c1ccc(c(c1)OC)OC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__