AG25774
531-88-4 | 5,6-Dimethoxy-3h-isobenzofuran-1-one
Manufacturer: A2B Chem
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CatalogNumber
AG25774
ChemicalName
5,6-Dimethoxy-3h-isobenzofuran-1-one
CasNumber
531-88-4
MolecularFormula
C10H10O4
MolecularWeight
194.184
MdlNumber
MFCD00086313
Smiles
COc1cc2C(=O)OCc2cc1OC
NscNumber
25379
Complexity
228
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
1.3
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CatalogNumber: AG25774
ChemicalName: 5,6-Dimethoxy-3h-isobenzofuran-1-one
CasNumber: 531-88-4
MolecularFormula: C10H10O4
MolecularWeight: 194.184
MdlNumber: MFCD00086313
Smiles: COc1cc2C(=O)OCc2cc1OC
NscNumber: 25379
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 1.3
CatalogNumber:
AG25774
ChemicalName:
5,6-Dimethoxy-3h-isobenzofuran-1-one
CasNumber:
531-88-4
MolecularFormula:
C10H10O4
MolecularWeight:
194.184
MdlNumber:
MFCD00086313
Smiles:
COc1cc2C(=O)OCc2cc1OC
NscNumber:
25379
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
1.3
CatalogNumber: __
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Smiles: ClCCCCCC(=O)c1cccc(c1)F
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Smiles:
ClCCCCCC(=O)c1cccc(c1)F
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RotatableBondCount:
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Smiles: COc1cc2OC(CC(=O)c2c(c1)OC)c1cc(OC)c(c(c1)OC)OC
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Complexity: __
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__
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MolecularFormula:
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Smiles:
COc1cc2OC(CC(=O)c2c(c1)OC)c1cc(OC)c(c(c1)OC)OC
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Complexity:
__
Covalently-bondedUnitCount:
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RotatableBondCount:
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Smiles: O=C1OC2(c3c1cc(cc3)C(=O)O)c1ccc(c(c1Oc1c2ccc(c1[As]1SCCS1)O)[As]1SCCS1)O
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
O=C1OC2(c3c1cc(cc3)C(=O)O)c1ccc(c(c1Oc1c2ccc(c1[As]1SCCS1)O)[As]1SCCS1)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__