AB47960
868-72-4 | Dimethyl 2,5-dibromohexanedioate
Manufacturer: A2B Chem
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CatalogNumber
AB47960
ChemicalName
Dimethyl 2,5-dibromohexanedioate
CasNumber
868-72-4
MolecularFormula
C8H12Br2O4
MolecularWeight
331.9865
MdlNumber
MFCD00043758
Smiles
COC(=O)C(CCC(C(=O)OC)Br)Br
Complexity
186
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
7
UndefinedAtomStereocenterCount
2
Xlogp3
2.4
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CatalogNumber: AB47960
ChemicalName: Dimethyl 2,5-dibromohexanedioate
CasNumber: 868-72-4
MolecularFormula: C8H12Br2O4
MolecularWeight: 331.9865
MdlNumber: MFCD00043758
Smiles: COC(=O)C(CCC(C(=O)OC)Br)Br
Complexity: 186
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 7
UndefinedAtomStereocenterCount: 2
Xlogp3: 2.4
CatalogNumber:
AB47960
ChemicalName:
Dimethyl 2,5-dibromohexanedioate
CasNumber:
868-72-4
MolecularFormula:
C8H12Br2O4
MolecularWeight:
331.9865
MdlNumber:
MFCD00043758
Smiles:
COC(=O)C(CCC(C(=O)OC)Br)Br
Complexity:
186
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
7
UndefinedAtomStereocenterCount:
2
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1c(Cl)ncnc1Cl
Complexity: 157
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 1.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1c(Cl)ncnc1Cl
Complexity:
157
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.7
CatalogNumber: AB47962
ChemicalName: N-(6-Chloro-pyridin-2-yl)-2,2-dimethyl-propionamide
CasNumber: 86847-84-9
MolecularFormula: C10H13ClN2O
MolecularWeight: 212.676
MdlNumber: MFCD07366729
Smiles: O=C(C(C)(C)C)Nc1cccc(n1)Cl
Complexity: 213
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: 2.7
CatalogNumber:
AB47962
ChemicalName:
N-(6-Chloro-pyridin-2-yl)-2,2-dimethyl-propionamide
CasNumber:
86847-84-9
MolecularFormula:
C10H13ClN2O
MolecularWeight:
212.676
MdlNumber:
MFCD07366729
Smiles:
O=C(C(C)(C)C)Nc1cccc(n1)Cl
Complexity:
213
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1ccnc(n1)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1ccnc(n1)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__