AA97440
1820705-16-5 | Methyl 3-bromo-2,4-dichlorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AA97440
ChemicalName
Methyl 3-bromo-2,4-dichlorobenzoate
CasNumber
1820705-16-5
MolecularFormula
C8H5BrCl2O2
MolecularWeight
283.9341
MdlNumber
MFCD27935903
Smiles
COC(=O)c1ccc(c(c1Cl)Br)Cl
Complexity
201
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
3.7
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CatalogNumber: AA97440
ChemicalName: Methyl 3-bromo-2,4-dichlorobenzoate
CasNumber: 1820705-16-5
MolecularFormula: C8H5BrCl2O2
MolecularWeight: 283.9341
MdlNumber: MFCD27935903
Smiles: COC(=O)c1ccc(c(c1Cl)Br)Cl
Complexity: 201
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 3.7
CatalogNumber:
AA97440
ChemicalName:
Methyl 3-bromo-2,4-dichlorobenzoate
CasNumber:
1820705-16-5
MolecularFormula:
C8H5BrCl2O2
MolecularWeight:
283.9341
MdlNumber:
MFCD27935903
Smiles:
COC(=O)c1ccc(c(c1Cl)Br)Cl
Complexity:
201
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
3.7
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Smiles: COc1cc2CNCCc2cc1[N+](=O)[O-].Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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Smiles:
COc1cc2CNCCc2cc1[N+](=O)[O-].Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
__
Xlogp3:
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MolecularFormula: __
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Smiles: CCOC(c1cc(Cl)nc(n1)C)OCC
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MolecularFormula:
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Smiles:
CCOC(c1cc(Cl)nc(n1)C)OCC
Complexity:
__
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: O=C(N1CC[C@H](C(C1)(F)F)N)OC(C)(C)C
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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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:
O=C(N1CC[C@H](C(C1)(F)F)N)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__