AG18785
54049-24-0 | Methyl 7-bromoheptanoate
Manufacturer: A2B Chem
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CatalogNumber
AG18785
ChemicalName
Methyl 7-bromoheptanoate
CasNumber
54049-24-0
MolecularFormula
C8H15BrO2
MolecularWeight
223.1075
MdlNumber
MFCD02258672
Smiles
BrCCCCCCC(=O)OC
Complexity
104
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
RotatableBondCount
7
Xlogp3
2.9
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CatalogNumber: AG18785
ChemicalName: Methyl 7-bromoheptanoate
CasNumber: 54049-24-0
MolecularFormula: C8H15BrO2
MolecularWeight: 223.1075
MdlNumber: MFCD02258672
Smiles: BrCCCCCCC(=O)OC
Complexity: 104
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 7
Xlogp3: 2.9
CatalogNumber:
AG18785
ChemicalName:
Methyl 7-bromoheptanoate
CasNumber:
54049-24-0
MolecularFormula:
C8H15BrO2
MolecularWeight:
223.1075
MdlNumber:
MFCD02258672
Smiles:
BrCCCCCCC(=O)OC
Complexity:
104
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
7
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: BrCCCCCCC(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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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:
BrCCCCCCC(C)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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MolecularFormula: __
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Smiles: OCCN(c1cc(nc2c1cccc2)C(F)(F)F)C
Complexity: __
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Smiles:
OCCN(c1cc(nc2c1cccc2)C(F)(F)F)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: Cn1c(nnc1S)Cc1onc(n1)c1cnccn1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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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:
Cn1c(nnc1S)Cc1onc(n1)c1cnccn1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__