AB17921
207596-29-0 | 1-Octanesulfonic acid sodium salt monohydrate
Manufacturer: A2B Chem
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CatalogNumber
AB17921
ChemicalName
1-Octanesulfonic acid sodium salt monohydrate
CasNumber
207596-29-0
MolecularFormula
C8H19NaO4S
MolecularWeight
234.2888
MdlNumber
MFCD00007544
Smiles
CCCCCCCCS(=O)(=O)[O-].[Na+].O
Complexity
184
Covalently-bondedUnitCount
3
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
7
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CatalogNumber: AB17921
ChemicalName: 1-Octanesulfonic acid sodium salt monohydrate
CasNumber: 207596-29-0
MolecularFormula: C8H19NaO4S
MolecularWeight: 234.2888
MdlNumber: MFCD00007544
Smiles: CCCCCCCCS(=O)(=O)[O-].[Na+].O
Complexity: 184
Covalently-bondedUnitCount: 3
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 7
CatalogNumber:
AB17921
ChemicalName:
1-Octanesulfonic acid sodium salt monohydrate
CasNumber:
207596-29-0
MolecularFormula:
C8H19NaO4S
MolecularWeight:
234.2888
MdlNumber:
MFCD00007544
Smiles:
CCCCCCCCS(=O)(=O)[O-].[Na+].O
Complexity:
184
Covalently-bondedUnitCount:
3
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@H](Cc1ccc(cc1)[N+](=O)[O-])N.O
Complexity: 243
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@H](Cc1ccc(cc1)[N+](=O)[O-])N.O
Complexity:
243
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1c[nH]c2c1cccc2)OCCN1CCCCC1.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1c[nH]c2c1cccc2)OCCN1CCCCC1.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CN=C(O1)NC(C1CC1)C1CC1.C1CN=C(O1)NC(C1CC1)C1CC1.OC(=O)/C=C/C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1CN=C(O1)NC(C1CC1)C1CC1.C1CN=C(O1)NC(C1CC1)C1CC1.OC(=O)/C=C/C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__