AB38644
2969-81-5 | Ethyl 4-bromobutyrate
Manufacturer: A2B Chem
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CatalogNumber
AB38644
ChemicalName
Ethyl 4-bromobutyrate
CasNumber
2969-81-5
MolecularFormula
C6H11BrO2
MolecularWeight
195.0543
MdlNumber
MFCD00000259
Smiles
BrCCCC(=O)OCC
NscNumber
133462
Complexity
83.1
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
2
RotatableBondCount
5
Xlogp3
1.5
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CatalogNumber: AB38644
ChemicalName: Ethyl 4-bromobutyrate
CasNumber: 2969-81-5
MolecularFormula: C6H11BrO2
MolecularWeight: 195.0543
MdlNumber: MFCD00000259
Smiles: BrCCCC(=O)OCC
NscNumber: 133462
Complexity: 83.1
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
RotatableBondCount: 5
Xlogp3: 1.5
CatalogNumber:
AB38644
ChemicalName:
Ethyl 4-bromobutyrate
CasNumber:
2969-81-5
MolecularFormula:
C6H11BrO2
MolecularWeight:
195.0543
MdlNumber:
MFCD00000259
Smiles:
BrCCCC(=O)OCC
NscNumber:
133462
Complexity:
83.1
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
RotatableBondCount:
5
Xlogp3:
1.5
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MolecularFormula: __
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Smiles: N1CCNCCNCCNCCNCCNCCNCCNCC1
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Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
N1CCNCCNCCNCCNCCNCCNCCNCC1
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Smiles: CCN1CCNC1=S
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Smiles:
CCN1CCNC1=S
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Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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Smiles: CCCOS(=O)(=O)C(F)(F)F
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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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MdlNumber:
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Smiles:
CCCOS(=O)(=O)C(F)(F)F
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__