AA07485
10191-18-1 | N,N-Bis(2-hydroxyethyl)-2-aminoethanesulphonic acid
Manufacturer: A2B Chem
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CatalogNumber
AA07485
ChemicalName
N,N-Bis(2-hydroxyethyl)-2-aminoethanesulphonic acid
CasNumber
10191-18-1
MolecularFormula
C6H15NO5S
MolecularWeight
213.252
MdlNumber
MFCD00007533
Smiles
OCCN(CCS(=O)(=O)O)CCO
NscNumber
166667
Complexity
204
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
3
RotatableBondCount
7
Xlogp3
-4.5
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CatalogNumber: AA07485
ChemicalName: N,N-Bis(2-hydroxyethyl)-2-aminoethanesulphonic acid
CasNumber: 10191-18-1
MolecularFormula: C6H15NO5S
MolecularWeight: 213.252
MdlNumber: MFCD00007533
Smiles: OCCN(CCS(=O)(=O)O)CCO
NscNumber: 166667
Complexity: 204
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 3
RotatableBondCount: 7
Xlogp3: -4.5
CatalogNumber:
AA07485
ChemicalName:
N,N-Bis(2-hydroxyethyl)-2-aminoethanesulphonic acid
CasNumber:
10191-18-1
MolecularFormula:
C6H15NO5S
MolecularWeight:
213.252
MdlNumber:
MFCD00007533
Smiles:
OCCN(CCS(=O)(=O)O)CCO
NscNumber:
166667
Complexity:
204
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
3
RotatableBondCount:
7
Xlogp3:
-4.5
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Smiles: NCc1cccc(c1)OCC1CCCCC1
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Complexity: __
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HydrogenBondAcceptorCount: __
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Xlogp3: __
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Smiles:
NCc1cccc(c1)OCC1CCCCC1
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HydrogenBondAcceptorCount:
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ChemicalName: __
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MolecularFormula: __
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Smiles: OC(=O)c1ccnc(c1)NC1CCCC1
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Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
OC(=O)c1ccnc(c1)NC1CCCC1
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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MolecularFormula: __
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Smiles: CCCNc1cc(ccn1)C(=O)O
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Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
CCCNc1cc(ccn1)C(=O)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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