AB46465
3998-90-1 | Methyl 2-chloro-6-methylpyridine-4-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB46465
ChemicalName
Methyl 2-chloro-6-methylpyridine-4-carboxylate
CasNumber
3998-90-1
MolecularFormula
C8H8ClNO2
MolecularWeight
185.6076
MdlNumber
MFCD04038391
Smiles
COC(=O)c1cc(C)nc(c1)Cl
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
2.1
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CatalogNumber: AB46465
ChemicalName: Methyl 2-chloro-6-methylpyridine-4-carboxylate
CasNumber: 3998-90-1
MolecularFormula: C8H8ClNO2
MolecularWeight: 185.6076
MdlNumber: MFCD04038391
Smiles: COC(=O)c1cc(C)nc(c1)Cl
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AB46465
ChemicalName:
Methyl 2-chloro-6-methylpyridine-4-carboxylate
CasNumber:
3998-90-1
MolecularFormula:
C8H8ClNO2
MolecularWeight:
185.6076
MdlNumber:
MFCD04038391
Smiles:
COC(=O)c1cc(C)nc(c1)Cl
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: AB46466
ChemicalName: Methyl 2-cyano-2,2-dimethylacetate
CasNumber: 72291-30-6
MolecularFormula: C6H9NO2
MolecularWeight: 127.1412
MdlNumber: MFCD03428328
Smiles: COC(=O)C(C#N)(C)C
Complexity: 163
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 0.9
CatalogNumber:
AB46466
ChemicalName:
Methyl 2-cyano-2,2-dimethylacetate
CasNumber:
72291-30-6
MolecularFormula:
C6H9NO2
MolecularWeight:
127.1412
MdlNumber:
MFCD03428328
Smiles:
COC(=O)C(C#N)(C)C
Complexity:
163
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
0.9
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Smiles: COC(=O)c1cccc(c1C#N)[N+](=O)[O-]
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COC(=O)c1cccc(c1C#N)[N+](=O)[O-]
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Smiles: COC(=O)c1ccc(cc1C)[N+](=O)[O-]
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
COC(=O)c1ccc(cc1C)[N+](=O)[O-]
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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