AB72724
925-47-3 | Diethyl 2,2'-thiodiacetate
Manufacturer: A2B Chem
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CatalogNumber
AB72724
ChemicalName
Diethyl 2,2'-thiodiacetate
CasNumber
925-47-3
MolecularFormula
C8H14O4S
MolecularWeight
206.2594
MdlNumber
MFCD00087932
Smiles
CCOC(=O)CSCC(=O)OCC
NscNumber
12576
Complexity
152
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
RotatableBondCount
8
Xlogp3
1.5
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CatalogNumber: AB72724
ChemicalName: Diethyl 2,2'-thiodiacetate
CasNumber: 925-47-3
MolecularFormula: C8H14O4S
MolecularWeight: 206.2594
MdlNumber: MFCD00087932
Smiles: CCOC(=O)CSCC(=O)OCC
NscNumber: 12576
Complexity: 152
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
RotatableBondCount: 8
Xlogp3: 1.5
CatalogNumber:
AB72724
ChemicalName:
Diethyl 2,2'-thiodiacetate
CasNumber:
925-47-3
MolecularFormula:
C8H14O4S
MolecularWeight:
206.2594
MdlNumber:
MFCD00087932
Smiles:
CCOC(=O)CSCC(=O)OCC
NscNumber:
12576
Complexity:
152
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
RotatableBondCount:
8
Xlogp3:
1.5
CatalogNumber: AB72725
ChemicalName: Diethyl 2-(2,4-dichlorophenyl)malonate
CasNumber: 111544-93-5
MolecularFormula: C13H14Cl2O4
MolecularWeight: 305.1539
MdlNumber: MFCD00831103
Smiles: CCOC(=O)C(c1ccc(cc1Cl)Cl)C(=O)OCC
NscNumber: __
Complexity: 304
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 7
Xlogp3: 3.8
CatalogNumber:
AB72725
ChemicalName:
Diethyl 2-(2,4-dichlorophenyl)malonate
CasNumber:
111544-93-5
MolecularFormula:
C13H14Cl2O4
MolecularWeight:
305.1539
MdlNumber:
MFCD00831103
Smiles:
CCOC(=O)C(c1ccc(cc1Cl)Cl)C(=O)OCC
NscNumber:
__
Complexity:
304
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
7
Xlogp3:
3.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCCP(=O)(OCC)OCC
NscNumber: __
Complexity: 130
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCCP(=O)(OCC)OCC
NscNumber:
__
Complexity:
130
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOP(=O)(C/C=C/C)OCC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOP(=O)(C/C=C/C)OCC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__