AC92740
71255-09-9 | 2-Methoxy-3-pyridinecarboxaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AC92740
ChemicalName
2-Methoxy-3-pyridinecarboxaldehyde
CasNumber
71255-09-9
MolecularFormula
C7H7NO2
MolecularWeight
137.13598
MdlNumber
MFCD04115112
Smiles
COc1ncccc1C=O
Complexity
116
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
0.6
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CatalogNumber: AC92740
ChemicalName: 2-Methoxy-3-pyridinecarboxaldehyde
CasNumber: 71255-09-9
MolecularFormula: C7H7NO2
MolecularWeight: 137.13598
MdlNumber: MFCD04115112
Smiles: COc1ncccc1C=O
Complexity: 116
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 0.6
CatalogNumber:
AC92740
ChemicalName:
2-Methoxy-3-pyridinecarboxaldehyde
CasNumber:
71255-09-9
MolecularFormula:
C7H7NO2
MolecularWeight:
137.13598
MdlNumber:
MFCD04115112
Smiles:
COc1ncccc1C=O
Complexity:
116
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
0.6
CatalogNumber: AC92744
ChemicalName: Bromo-(4-fluoro-phenyl)-acetic acid ethyl ester
CasNumber: 712-52-7
MolecularFormula: C10H10BrFO2
MolecularWeight: 261.0876
MdlNumber: MFCD00204082
Smiles: CCOC(=O)C(c1ccc(cc1)F)Br
Complexity: 191
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 3.1
CatalogNumber:
AC92744
ChemicalName:
Bromo-(4-fluoro-phenyl)-acetic acid ethyl ester
CasNumber:
712-52-7
MolecularFormula:
C10H10BrFO2
MolecularWeight:
261.0876
MdlNumber:
MFCD00204082
Smiles:
CCOC(=O)C(c1ccc(cc1)F)Br
Complexity:
191
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
3.1
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Smiles: O=C1NCCNCCNCCNC(=O)C1
Complexity: __
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Smiles:
O=C1NCCNCCNCCNC(=O)C1
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: O=C1CCN(C(=O)N1)C1CCCCC1
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HydrogenBondAcceptorCount: __
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Smiles:
O=C1CCN(C(=O)N1)C1CCCCC1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__