AD61997
19477-73-7 | 6-Bromo-3H-isobenzofuran-1-one
Manufacturer: A2B Chem
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CatalogNumber
AD61997
ChemicalName
6-Bromo-3H-isobenzofuran-1-one
CasNumber
19477-73-7
MolecularFormula
C8H5BrO2
MolecularWeight
213.0281
MdlNumber
MFCD03428561
Smiles
Brc1ccc2c(c1)C(=O)OC2
NscNumber
95680
Complexity
181
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
Xlogp3
1.5
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CatalogNumber: AD61997
ChemicalName: 6-Bromo-3H-isobenzofuran-1-one
CasNumber: 19477-73-7
MolecularFormula: C8H5BrO2
MolecularWeight: 213.0281
MdlNumber: MFCD03428561
Smiles: Brc1ccc2c(c1)C(=O)OC2
NscNumber: 95680
Complexity: 181
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
Xlogp3: 1.5
CatalogNumber:
AD61997
ChemicalName:
6-Bromo-3H-isobenzofuran-1-one
CasNumber:
19477-73-7
MolecularFormula:
C8H5BrO2
MolecularWeight:
213.0281
MdlNumber:
MFCD03428561
Smiles:
Brc1ccc2c(c1)C(=O)OC2
NscNumber:
95680
Complexity:
181
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
Xlogp3:
1.5
CatalogNumber: __
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Smiles: CC(CCOC(=O)C(=C)C#N)C
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Complexity: __
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HydrogenBondAcceptorCount: __
Xlogp3: __
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Smiles:
CC(CCOC(=O)C(=C)C#N)C
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Smiles: c1ccc2c(c1)ccc1c2ccc2c1c1ccccc1cc2
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Smiles:
c1ccc2c(c1)ccc1c2ccc2c1c1ccccc1cc2
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Smiles: O=C1C=C2[C@@H]([C@@]3([C@H]1C[C@@H](O)[C@H](C3)O)C)CC[C@]1(C2(O)CCC1=O)C
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Smiles:
O=C1C=C2[C@@H]([C@@]3([C@H]1C[C@@H](O)[C@H](C3)O)C)CC[C@]1(C2(O)CCC1=O)C
NscNumber:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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Xlogp3:
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