AD63251
18617-50-0 | 6-Hydroxynicotinic acid ethyl ester
Manufacturer: A2B Chem
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CatalogNumber
AD63251
ChemicalName
6-Hydroxynicotinic acid ethyl ester
CasNumber
18617-50-0
MolecularFormula
C8H9NO3
MolecularWeight
167.162
MdlNumber
MFCD08460993
Smiles
CCOC(=O)c1ccc(=O)[nH]c1
NscNumber
165477
Complexity
266
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.1
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CatalogNumber: AD63251
ChemicalName: 6-Hydroxynicotinic acid ethyl ester
CasNumber: 18617-50-0
MolecularFormula: C8H9NO3
MolecularWeight: 167.162
MdlNumber: MFCD08460993
Smiles: CCOC(=O)c1ccc(=O)[nH]c1
NscNumber: 165477
Complexity: 266
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.1
CatalogNumber:
AD63251
ChemicalName:
6-Hydroxynicotinic acid ethyl ester
CasNumber:
18617-50-0
MolecularFormula:
C8H9NO3
MolecularWeight:
167.162
MdlNumber:
MFCD08460993
Smiles:
CCOC(=O)c1ccc(=O)[nH]c1
NscNumber:
165477
Complexity:
266
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.1
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MolecularFormula: __
MolecularWeight: __
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Smiles: [O-][N+](=O)c1cnc(c(c1)[N+](=O)[O-])F
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
[O-][N+](=O)c1cnc(c(c1)[N+](=O)[O-])F
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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RotatableBondCount:
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Smiles: SCC(=C)Cl
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Smiles:
SCC(=C)Cl
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: OC(=O)c1cccc(n1)S(=O)(=O)O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cccc(n1)S(=O)(=O)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__