AB79339
75308-46-2 | tert-Butyl 2,6-dichloroisonicotinate
Manufacturer: A2B Chem
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CatalogNumber
AB79339
ChemicalName
tert-Butyl 2,6-dichloroisonicotinate
CasNumber
75308-46-2
MolecularFormula
C10H11Cl2NO2
MolecularWeight
248.1058
MdlNumber
MFCD08445655
Smiles
O=C(c1cc(Cl)nc(c1)Cl)OC(C)(C)C
Complexity
230
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
3.6
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CatalogNumber: AB79339
ChemicalName: tert-Butyl 2,6-dichloroisonicotinate
CasNumber: 75308-46-2
MolecularFormula: C10H11Cl2NO2
MolecularWeight: 248.1058
MdlNumber: MFCD08445655
Smiles: O=C(c1cc(Cl)nc(c1)Cl)OC(C)(C)C
Complexity: 230
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 3.6
CatalogNumber:
AB79339
ChemicalName:
tert-Butyl 2,6-dichloroisonicotinate
CasNumber:
75308-46-2
MolecularFormula:
C10H11Cl2NO2
MolecularWeight:
248.1058
MdlNumber:
MFCD08445655
Smiles:
O=C(c1cc(Cl)nc(c1)Cl)OC(C)(C)C
Complexity:
230
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
3.6
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Smiles: O=C(OC(C)(C)C)C[C@H]1C[C@@H](COC(=O)C)OC(O1)(C)C
Complexity: __
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HydrogenBondAcceptorCount: __
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Smiles:
O=C(OC(C)(C)C)C[C@H]1C[C@@H](COC(=O)C)OC(O1)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
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RotatableBondCount:
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Smiles: ICC(c1ccc(cc1)Cl)(OCCNC(=O)OC(C)(C)C)C
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HeavyAtomCount: __
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Smiles:
ICC(c1ccc(cc1)Cl)(OCCNC(=O)OC(C)(C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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MolecularFormula: __
MolecularWeight: __
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Smiles: O=C(c1ccccc1N)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1ccccc1N)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__