AD08249
66411-55-0 | 1,3-Benzodioxole-4-carbonyl chloride
Manufacturer: A2B Chem
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CatalogNumber
AD08249
ChemicalName
1,3-Benzodioxole-4-carbonyl chloride
CasNumber
66411-55-0
MolecularFormula
C8H5ClO3
MolecularWeight
184.5765
MdlNumber
MFCD13174065
Smiles
ClC(=O)c1cccc2c1OCO2
Complexity
195
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
2.2
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CatalogNumber: AD08249
ChemicalName: 1,3-Benzodioxole-4-carbonyl chloride
CasNumber: 66411-55-0
MolecularFormula: C8H5ClO3
MolecularWeight: 184.5765
MdlNumber: MFCD13174065
Smiles: ClC(=O)c1cccc2c1OCO2
Complexity: 195
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 2.2
CatalogNumber:
AD08249
ChemicalName:
1,3-Benzodioxole-4-carbonyl chloride
CasNumber:
66411-55-0
MolecularFormula:
C8H5ClO3
MolecularWeight:
184.5765
MdlNumber:
MFCD13174065
Smiles:
ClC(=O)c1cccc2c1OCO2
Complexity:
195
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
2.2
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Smiles: NN/C=C(/S(=O)(=O)c1ccc(cc1)Cl)C#N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
NN/C=C(/S(=O)(=O)c1ccc(cc1)Cl)C#N
Complexity:
__
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HydrogenBondAcceptorCount:
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Smiles: O=C(c1ccccc1Cl)Nc1ccccc1
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Smiles:
O=C(c1ccccc1Cl)Nc1ccccc1
Complexity:
__
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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Smiles: COC(=O)/C=C/c1ccc(c(c1)O)O
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
COC(=O)/C=C/c1ccc(c(c1)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__