AA36135
1261797-04-9 | Methyl 2-bromo-3-iodobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AA36135
ChemicalName
Methyl 2-bromo-3-iodobenzoate
CasNumber
1261797-04-9
MolecularFormula
C8H6BrIO2
MolecularWeight
340.9405
MdlNumber
MFCD11520418
Smiles
COC(=O)c1cccc(c1Br)I
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
3.1
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CatalogNumber: AA36135
ChemicalName: Methyl 2-bromo-3-iodobenzoate
CasNumber: 1261797-04-9
MolecularFormula: C8H6BrIO2
MolecularWeight: 340.9405
MdlNumber: MFCD11520418
Smiles: COC(=O)c1cccc(c1Br)I
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 3.1
CatalogNumber:
AA36135
ChemicalName:
Methyl 2-bromo-3-iodobenzoate
CasNumber:
1261797-04-9
MolecularFormula:
C8H6BrIO2
MolecularWeight:
340.9405
MdlNumber:
MFCD11520418
Smiles:
COC(=O)c1cccc(c1Br)I
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
3.1
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: COC(=O)c1cccc(c1Br)C#N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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Smiles:
COC(=O)c1cccc(c1Br)C#N
Complexity:
__
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
__
Xlogp3:
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Smiles: OC(=O)CCc1cc(O)ccc1Cl
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MolecularFormula:
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Smiles:
OC(=O)CCc1cc(O)ccc1Cl
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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Smiles: N#CCc1ccc(c(c1)[N+](=O)[O-])Br
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HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
N#CCc1ccc(c(c1)[N+](=O)[O-])Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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