AH19595
717880-58-5 | Methyl 2-bromo-5-iodobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AH19595
ChemicalName
Methyl 2-bromo-5-iodobenzoate
CasNumber
717880-58-5
MolecularFormula
C8H6BrIO2
MolecularWeight
340.94051
MdlNumber
MFCD01851253
Smiles
COC(=O)c1cc(I)ccc1Br
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
3.1
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CatalogNumber: AH19595
ChemicalName: Methyl 2-bromo-5-iodobenzoate
CasNumber: 717880-58-5
MolecularFormula: C8H6BrIO2
MolecularWeight: 340.94051
MdlNumber: MFCD01851253
Smiles: COC(=O)c1cc(I)ccc1Br
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 3.1
CatalogNumber:
AH19595
ChemicalName:
Methyl 2-bromo-5-iodobenzoate
CasNumber:
717880-58-5
MolecularFormula:
C8H6BrIO2
MolecularWeight:
340.94051
MdlNumber:
MFCD01851253
Smiles:
COC(=O)c1cc(I)ccc1Br
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
3.1
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: O=C(NN=Cc1ccccc1O)N/N=C/c1ccccc1O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
O=C(NN=Cc1ccccc1O)N/N=C/c1ccccc1O
Complexity:
__
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__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CCNCC(O)(C)C
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Smiles:
CCNCC(O)(C)C
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Smiles: OCc1[nH]c2c(n1)cc(c(c2)C)C
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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:
OCc1[nH]c2c(n1)cc(c(c2)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__