AF02548
184368-74-9 | 1-tert-Butyl 4-methyl 5,6-dihydropyridine-1,4(2h)-dicarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AF02548
ChemicalName
1-tert-Butyl 4-methyl 5,6-dihydropyridine-1,4(2h)-dicarboxylate
CasNumber
184368-74-9
MolecularFormula
C12H19NO4
MolecularWeight
241.2836
MdlNumber
MFCD23704701
Smiles
COC(=O)C1=CCN(CC1)C(=O)OC(C)(C)C
Complexity
341
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
RotatableBondCount
4
Xlogp3
1.4
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CatalogNumber: AF02548
ChemicalName: 1-tert-Butyl 4-methyl 5,6-dihydropyridine-1,4(2h)-dicarboxylate
CasNumber: 184368-74-9
MolecularFormula: C12H19NO4
MolecularWeight: 241.2836
MdlNumber: MFCD23704701
Smiles: COC(=O)C1=CCN(CC1)C(=O)OC(C)(C)C
Complexity: 341
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 1.4
CatalogNumber:
AF02548
ChemicalName:
1-tert-Butyl 4-methyl 5,6-dihydropyridine-1,4(2h)-dicarboxylate
CasNumber:
184368-74-9
MolecularFormula:
C12H19NO4
MolecularWeight:
241.2836
MdlNumber:
MFCD23704701
Smiles:
COC(=O)C1=CCN(CC1)C(=O)OC(C)(C)C
Complexity:
341
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
1.4
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Smiles: Clc1cc2[nH]c(cc2cc1Cl)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
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Smiles:
Clc1cc2[nH]c(cc2cc1Cl)C(=O)O
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Smiles: CCOC(=O)c1cnc2n(c1O)ncc2c1ccccc1
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Smiles:
CCOC(=O)c1cnc2n(c1O)ncc2c1ccccc1
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: OC(=O)c1cc(ccc1F)C1OCCO1
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HydrogenBondAcceptorCount: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
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Smiles:
OC(=O)c1cc(ccc1F)C1OCCO1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__