AB38106
29547-04-4 | Methyl 2,4-dibromobutyrate
Manufacturer: A2B Chem
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CatalogNumber
AB38106
ChemicalName
Methyl 2,4-dibromobutyrate
CasNumber
29547-04-4
MolecularFormula
C5H8Br2O2
MolecularWeight
259.9238
MdlNumber
MFCD00130152
Smiles
COC(=O)C(CCBr)Br
NscNumber
167181
Complexity
95
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
2
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
2.1
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CatalogNumber: AB38106
ChemicalName: Methyl 2,4-dibromobutyrate
CasNumber: 29547-04-4
MolecularFormula: C5H8Br2O2
MolecularWeight: 259.9238
MdlNumber: MFCD00130152
Smiles: COC(=O)C(CCBr)Br
NscNumber: 167181
Complexity: 95
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.1
CatalogNumber:
AB38106
ChemicalName:
Methyl 2,4-dibromobutyrate
CasNumber:
29547-04-4
MolecularFormula:
C5H8Br2O2
MolecularWeight:
259.9238
MdlNumber:
MFCD00130152
Smiles:
COC(=O)C(CCBr)Br
NscNumber:
167181
Complexity:
95
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.1
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Smiles: CCCCCCCCCCCCCC1(CCCC(=O)O)OCC(N1[O])(C)C
NscNumber: __
Complexity: __
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Smiles:
CCCCCCCCCCCCCC1(CCCC(=O)O)OCC(N1[O])(C)C
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Smiles: OC(=O)[C@H](C(C(=O)O)C)N
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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:
OC(=O)[C@H](C(C(=O)O)C)N
NscNumber:
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Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC(=O)CCC(=O)CC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCC(=O)CCC(=O)CC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__