AI06303
104179-54-6 | methyl 3-hydroxy-2-methylquinoline-4-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI06303
ChemicalName
methyl 3-hydroxy-2-methylquinoline-4-carboxylate
CasNumber
104179-54-6
MolecularFormula
C12H11NO3
MolecularWeight
217.2206
MdlNumber
MFCD27578194
Smiles
COC(=O)c1c(O)c(C)nc2c1cccc2
Complexity
269
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.6
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CatalogNumber: AI06303
ChemicalName: methyl 3-hydroxy-2-methylquinoline-4-carboxylate
CasNumber: 104179-54-6
MolecularFormula: C12H11NO3
MolecularWeight: 217.2206
MdlNumber: MFCD27578194
Smiles: COC(=O)c1c(O)c(C)nc2c1cccc2
Complexity: 269
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.6
CatalogNumber:
AI06303
ChemicalName:
methyl 3-hydroxy-2-methylquinoline-4-carboxylate
CasNumber:
104179-54-6
MolecularFormula:
C12H11NO3
MolecularWeight:
217.2206
MdlNumber:
MFCD27578194
Smiles:
COC(=O)c1c(O)c(C)nc2c1cccc2
Complexity:
269
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.6
CatalogNumber: __
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MolecularFormula: __
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Smiles: B(C1=NC=CN=C1N)(O)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
B(C1=NC=CN=C1N)(O)O
Complexity:
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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: COc1cc2nnc(c(c2cc1Br)O)C(=O)O
Complexity: __
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Smiles:
COc1cc2nnc(c(c2cc1Br)O)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: Oc1ccccc1CN1CCCC1
Complexity: __
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HydrogenBondDonorCount: __
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ChemicalName:
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MolecularFormula:
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Smiles:
Oc1ccccc1CN1CCCC1
Complexity:
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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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Xlogp3:
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