AB76436
4985-85-7 | N-(3-Aminopropyl)diethanolamine
Manufacturer: A2B Chem
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CatalogNumber
AB76436
ChemicalName
N-(3-Aminopropyl)diethanolamine
CasNumber
4985-85-7
MolecularFormula
C7H18N2O2
MolecularWeight
162.23
MdlNumber
MFCD00047971
Smiles
NCCCN(CCO)CCO
NscNumber
8172
Complexity
74.8
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
7
Xlogp3
-1.7
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CatalogNumber: AB76436
ChemicalName: N-(3-Aminopropyl)diethanolamine
CasNumber: 4985-85-7
MolecularFormula: C7H18N2O2
MolecularWeight: 162.23
MdlNumber: MFCD00047971
Smiles: NCCCN(CCO)CCO
NscNumber: 8172
Complexity: 74.8
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 7
Xlogp3: -1.7
CatalogNumber:
AB76436
ChemicalName:
N-(3-Aminopropyl)diethanolamine
CasNumber:
4985-85-7
MolecularFormula:
C7H18N2O2
MolecularWeight:
162.23
MdlNumber:
MFCD00047971
Smiles:
NCCCN(CCO)CCO
NscNumber:
8172
Complexity:
74.8
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
7
Xlogp3:
-1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCCCNCC(=O)O.Cl.Cl
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCCCNCC(=O)O.Cl.Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCCCN(c1ccccc1)C
NscNumber: __
Complexity: 108
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCCCN(c1ccccc1)C
NscNumber:
__
Complexity:
108
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCCN(c1cccc(c1)NC(=O)C)CCO
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCCN(c1cccc(c1)NC(=O)C)CCO
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__