AD23578
220000-86-2 | 4-Chloropyridine-2-carboxylic acid tert-butyl ester
Manufacturer: A2B Chem
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CatalogNumber
AD23578
ChemicalName
4-Chloropyridine-2-carboxylic acid tert-butyl ester
CasNumber
220000-86-2
MolecularFormula
C10H12ClNO2
MolecularWeight
213.6608
MdlNumber
MFCD10565714
Smiles
O=C(c1nccc(c1)Cl)OC(C)(C)C
Complexity
213
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
2.7
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CatalogNumber: AD23578
ChemicalName: 4-Chloropyridine-2-carboxylic acid tert-butyl ester
CasNumber: 220000-86-2
MolecularFormula: C10H12ClNO2
MolecularWeight: 213.6608
MdlNumber: MFCD10565714
Smiles: O=C(c1nccc(c1)Cl)OC(C)(C)C
Complexity: 213
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.7
CatalogNumber:
AD23578
ChemicalName:
4-Chloropyridine-2-carboxylic acid tert-butyl ester
CasNumber:
220000-86-2
MolecularFormula:
C10H12ClNO2
MolecularWeight:
213.6608
MdlNumber:
MFCD10565714
Smiles:
O=C(c1nccc(c1)Cl)OC(C)(C)C
Complexity:
213
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.7
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Smiles: Brc1ccc2c(c1)cc(c(=O)o2)C(=O)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
Brc1ccc2c(c1)cc(c(=O)o2)C(=O)Cl
Complexity:
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HydrogenBondAcceptorCount:
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Smiles: Brc1ccc(cc1)C=Cc1ccc(cc1)N(c1ccccc1)c1ccccc1
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Smiles:
Brc1ccc(cc1)C=Cc1ccc(cc1)N(c1ccccc1)c1ccccc1
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__
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__
HeavyAtomCount:
__
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Smiles: Clc1cc(Cl)c2c(c1)cc(c(=O)o2)C(=O)O
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Smiles:
Clc1cc(Cl)c2c(c1)cc(c(=O)o2)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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