AB73506
135716-08-4 | tert-butyl 4-(2-ethoxy-2-oxoethylidene)piperidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB73506
ChemicalName
tert-butyl 4-(2-ethoxy-2-oxoethylidene)piperidine-1-carboxylate
CasNumber
135716-08-4
MolecularFormula
C14H23NO4
MolecularWeight
269.3367
MdlNumber
MFCD12912655
Smiles
CCOC(=O)C=C1CCN(CC1)C(=O)OC(C)(C)C
Complexity
358
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
RotatableBondCount
5
Xlogp3
1.7
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CatalogNumber: AB73506
ChemicalName: tert-butyl 4-(2-ethoxy-2-oxoethylidene)piperidine-1-carboxylate
CasNumber: 135716-08-4
MolecularFormula: C14H23NO4
MolecularWeight: 269.3367
MdlNumber: MFCD12912655
Smiles: CCOC(=O)C=C1CCN(CC1)C(=O)OC(C)(C)C
Complexity: 358
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
Xlogp3: 1.7
CatalogNumber:
AB73506
ChemicalName:
tert-butyl 4-(2-ethoxy-2-oxoethylidene)piperidine-1-carboxylate
CasNumber:
135716-08-4
MolecularFormula:
C14H23NO4
MolecularWeight:
269.3367
MdlNumber:
MFCD12912655
Smiles:
CCOC(=O)C=C1CCN(CC1)C(=O)OC(C)(C)C
Complexity:
358
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
Xlogp3:
1.7
CatalogNumber: AB73507
ChemicalName: Ethyl 3-indoleacetate
CasNumber: 778-82-5
MolecularFormula: C12H13NO2
MolecularWeight: 203.2371200000001
MdlNumber: MFCD00005635
Smiles: CCOC(=O)Cc1c[nH]c2c1cccc2
Complexity: 230
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
Xlogp3: 2.1
CatalogNumber:
AB73507
ChemicalName:
Ethyl 3-indoleacetate
CasNumber:
778-82-5
MolecularFormula:
C12H13NO2
MolecularWeight:
203.2371200000001
MdlNumber:
MFCD00005635
Smiles:
CCOC(=O)Cc1c[nH]c2c1cccc2
Complexity:
230
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C(=O)c1csc(=N)[nH]1
Complexity: 222
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1
CatalogNumber:
__
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCOC(=O)C(=O)c1csc(=N)[nH]1
Complexity:
222
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1
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MolecularFormula: __
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Smiles: CCOC(=O)COc1c(Br)cccc1C=O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCOC(=O)COc1c(Br)cccc1C=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__