AC87903
99147-12-3 | (R)-Dimethyl bromosuccinate
Manufacturer: A2B Chem
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CatalogNumber
AC87903
ChemicalName
(R)-Dimethyl bromosuccinate
CasNumber
99147-12-3
MolecularFormula
C6H9BrO4
MolecularWeight
225.0373
MdlNumber
MFCD11974034
Smiles
COC(=O)C[C@H](C(=O)OC)Br
Complexity
157
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
RotatableBondCount
5
Xlogp3
0.8
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CatalogNumber: AC87903
ChemicalName: (R)-Dimethyl bromosuccinate
CasNumber: 99147-12-3
MolecularFormula: C6H9BrO4
MolecularWeight: 225.0373
MdlNumber: MFCD11974034
Smiles: COC(=O)C[C@H](C(=O)OC)Br
Complexity: 157
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
Xlogp3: 0.8
CatalogNumber:
AC87903
ChemicalName:
(R)-Dimethyl bromosuccinate
CasNumber:
99147-12-3
MolecularFormula:
C6H9BrO4
MolecularWeight:
225.0373
MdlNumber:
MFCD11974034
Smiles:
COC(=O)C[C@H](C(=O)OC)Br
Complexity:
157
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: NNc1nc2c([nH]1)cc(cc2)C(=O)O
Complexity: __
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DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
NNc1nc2c([nH]1)cc(cc2)C(=O)O
Complexity:
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Covalently-bondedUnitCount:
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DefinedAtomStereocenterCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: CS(=O)(=O)O.Oc1cc2nc(sc2c(c1O)[N+](=O)[O-])c1ccncc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
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Xlogp3: __
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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:
CS(=O)(=O)O.Oc1cc2nc(sc2c(c1O)[N+](=O)[O-])c1ccncc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: CCCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCCC(=O)[O-].[Fe+3]
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
CCCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCCC(=O)[O-].[Fe+3]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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