AB43814
5339-85-5 | 2-Aminophenethanol
Manufacturer: A2B Chem
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CatalogNumber
AB43814
ChemicalName
2-Aminophenethanol
CasNumber
5339-85-5
MolecularFormula
C8H11NO
MolecularWeight
137.179
MdlNumber
MFCD00007754
Smiles
OCCc1ccccc1N
NscNumber
3572
Complexity
95.3
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
0.5
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CatalogNumber: AB43814
ChemicalName: 2-Aminophenethanol
CasNumber: 5339-85-5
MolecularFormula: C8H11NO
MolecularWeight: 137.179
MdlNumber: MFCD00007754
Smiles: OCCc1ccccc1N
NscNumber: 3572
Complexity: 95.3
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 0.5
CatalogNumber:
AB43814
ChemicalName:
2-Aminophenethanol
CasNumber:
5339-85-5
MolecularFormula:
C8H11NO
MolecularWeight:
137.179
MdlNumber:
MFCD00007754
Smiles:
OCCc1ccccc1N
NscNumber:
3572
Complexity:
95.3
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
0.5
CatalogNumber: AB43815
ChemicalName: 2-Aminonicotinic acid
CasNumber: 5345-47-1
MolecularFormula: C6H6N2O2
MolecularWeight: 138.124
MdlNumber: MFCD00006318
Smiles: OC(=O)c1cccnc1N
NscNumber: 3049
Complexity: 138
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AB43815
ChemicalName:
2-Aminonicotinic acid
CasNumber:
5345-47-1
MolecularFormula:
C6H6N2O2
MolecularWeight:
138.124
MdlNumber:
MFCD00006318
Smiles:
OC(=O)c1cccnc1N
NscNumber:
3049
Complexity:
138
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ncccn1
NscNumber: __
Complexity: 48.9
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: -0.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1ncccn1
NscNumber:
__
Complexity:
48.9
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
-0.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cnc(nc1)N
NscNumber: __
Complexity: 131
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: -0.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cnc(nc1)N
NscNumber:
__
Complexity:
131
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
-0.6