AB46691
104-63-2 | N-Benzylethanolamine
Manufacturer: A2B Chem
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CatalogNumber
AB46691
ChemicalName
N-Benzylethanolamine
CasNumber
104-63-2
MolecularFormula
C9H13NO
MolecularWeight
151.2056
MdlNumber
MFCD00002840
Smiles
OCCNCc1ccccc1
Complexity
89.6
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
4
Xlogp3
0.8
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CatalogNumber: AB46691
ChemicalName: N-Benzylethanolamine
CasNumber: 104-63-2
MolecularFormula: C9H13NO
MolecularWeight: 151.2056
MdlNumber: MFCD00002840
Smiles: OCCNCc1ccccc1
Complexity: 89.6
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 0.8
CatalogNumber:
AB46691
ChemicalName:
N-Benzylethanolamine
CasNumber:
104-63-2
MolecularFormula:
C9H13NO
MolecularWeight:
151.2056
MdlNumber:
MFCD00002840
Smiles:
OCCNCc1ccccc1
Complexity:
89.6
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CNCc1ccccc1
Complexity: 65
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CNCc1ccccc1
Complexity:
65
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CCC(=CC1)B1OC(C(O1)(C)C)(C)C)OC(C)(C)C
Complexity: 463
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1CCC(=CC1)B1OC(C(O1)(C)C)(C)C)OC(C)(C)C
Complexity:
463
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCCCNC(=O)OC(C)(C)C
Complexity: 141
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCCCNC(=O)OC(C)(C)C
Complexity:
141
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.3