AA69428
14208-83-4 | 3-Amino-isonicotinic acid ethyl ester
Manufacturer: A2B Chem
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CatalogNumber
AA69428
ChemicalName
3-Amino-isonicotinic acid ethyl ester
CasNumber
14208-83-4
MolecularFormula
C8H10N2O2
MolecularWeight
166.1772
MdlNumber
MFCD03788270
Smiles
CCOC(=O)c1ccncc1N
Complexity
161
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.9
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CatalogNumber: AA69428
ChemicalName: 3-Amino-isonicotinic acid ethyl ester
CasNumber: 14208-83-4
MolecularFormula: C8H10N2O2
MolecularWeight: 166.1772
MdlNumber: MFCD03788270
Smiles: CCOC(=O)c1ccncc1N
Complexity: 161
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.9
CatalogNumber:
AA69428
ChemicalName:
3-Amino-isonicotinic acid ethyl ester
CasNumber:
14208-83-4
MolecularFormula:
C8H10N2O2
MolecularWeight:
166.1772
MdlNumber:
MFCD03788270
Smiles:
CCOC(=O)c1ccncc1N
Complexity:
161
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1snc(c1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
Nc1snc(c1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: CC(c1ccccc1)(C[Sn](CC(c1ccccc1)(C)C)(Cl)Cl)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
CC(c1ccccc1)(C[Sn](CC(c1ccccc1)(C)C)(Cl)Cl)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
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Smiles: c1cc[n+](cc1)Cc1ccc(cc1)C[n+]1ccccc1.[Br-].[Br-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
c1cc[n+](cc1)Cc1ccc(cc1)C[n+]1ccccc1.[Br-].[Br-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__