AA10014
102601-34-3 | CAPSO sodium salt
Manufacturer: A2B Chem
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CatalogNumber
AA10014
ChemicalName
CAPSO sodium salt
CasNumber
102601-34-3
MolecularFormula
C9H18NNaO4S
MolecularWeight
259.2983
MdlNumber
MFCD00070063
Smiles
OC(CS(=O)(=O)[O-])CNC1CCCCC1.[Na+]
Complexity
272
Covalently-bondedUnitCount
2
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
5
UndefinedAtomStereocenterCount
1
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CatalogNumber: AA10014
ChemicalName: CAPSO sodium salt
CasNumber: 102601-34-3
MolecularFormula: C9H18NNaO4S
MolecularWeight: 259.2983
MdlNumber: MFCD00070063
Smiles: OC(CS(=O)(=O)[O-])CNC1CCCCC1.[Na+]
Complexity: 272
Covalently-bondedUnitCount: 2
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AA10014
ChemicalName:
CAPSO sodium salt
CasNumber:
102601-34-3
MolecularFormula:
C9H18NNaO4S
MolecularWeight:
259.2983
MdlNumber:
MFCD00070063
Smiles:
OC(CS(=O)(=O)[O-])CNC1CCCCC1.[Na+]
Complexity:
272
Covalently-bondedUnitCount:
2
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C=NCCCCCCCCCCC(=O)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C=NCCCCCCCCCCC(=O)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C=CCOC(=O)c1ccc(cc1)C(=O)OCC=C
Complexity: 282
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C=CCOC(=O)c1ccc(cc1)C(=O)OCC=C
Complexity:
282
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)C(=O)CCN1CCCCC1.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)C(=O)CCN1CCCCC1.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__