AB01314
17880-61-4 | Methyl 5-ethynylpyridine-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB01314
ChemicalName
Methyl 5-ethynylpyridine-2-carboxylate
CasNumber
17880-61-4
MolecularFormula
C9H7NO2
MolecularWeight
161.1574
MdlNumber
MFCD13189756
Smiles
COC(=O)c1ccc(cn1)C#C
Complexity
216
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
1.3
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CatalogNumber: AB01314
ChemicalName: Methyl 5-ethynylpyridine-2-carboxylate
CasNumber: 17880-61-4
MolecularFormula: C9H7NO2
MolecularWeight: 161.1574
MdlNumber: MFCD13189756
Smiles: COC(=O)c1ccc(cn1)C#C
Complexity: 216
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 1.3
CatalogNumber:
AB01314
ChemicalName:
Methyl 5-ethynylpyridine-2-carboxylate
CasNumber:
17880-61-4
MolecularFormula:
C9H7NO2
MolecularWeight:
161.1574
MdlNumber:
MFCD13189756
Smiles:
COC(=O)c1ccc(cn1)C#C
Complexity:
216
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: C#Cc1ccc(nc1)C(=O)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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Smiles:
C#Cc1ccc(nc1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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Smiles: Cc1nc2ccccc2c(=O)n1c1cccc(c1)C(F)(F)F
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Smiles:
Cc1nc2ccccc2c(=O)n1c1cccc(c1)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: Brc1ccc(cc1)n1c(C)nc2c(c1=O)cccc2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
Brc1ccc(cc1)n1c(C)nc2c(c1=O)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__