AI61237
914349-34-1 | tert-Butyl 3-bromo-6-methyl-1H-indole-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI61237
ChemicalName
tert-Butyl 3-bromo-6-methyl-1H-indole-1-carboxylate
CasNumber
914349-34-1
MolecularFormula
C14H16BrNO2
MolecularWeight
310.1863
MdlNumber
MFCD05864782
Smiles
Cc1ccc2c(c1)n(cc2Br)C(=O)OC(C)(C)C
Complexity
326
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
4.3
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CatalogNumber: AI61237
ChemicalName: tert-Butyl 3-bromo-6-methyl-1H-indole-1-carboxylate
CasNumber: 914349-34-1
MolecularFormula: C14H16BrNO2
MolecularWeight: 310.1863
MdlNumber: MFCD05864782
Smiles: Cc1ccc2c(c1)n(cc2Br)C(=O)OC(C)(C)C
Complexity: 326
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 4.3
CatalogNumber:
AI61237
ChemicalName:
tert-Butyl 3-bromo-6-methyl-1H-indole-1-carboxylate
CasNumber:
914349-34-1
MolecularFormula:
C14H16BrNO2
MolecularWeight:
310.1863
MdlNumber:
MFCD05864782
Smiles:
Cc1ccc2c(c1)n(cc2Br)C(=O)OC(C)(C)C
Complexity:
326
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
4.3
CatalogNumber: AI61238
ChemicalName: 1-Boc-3-bromo-7-nitroindole
CasNumber: 914349-37-4
MolecularFormula: C13H13BrN2O4
MolecularWeight: 341.15731999999997
MdlNumber: MFCD05864785
Smiles: [O-][N+](=O)c1cccc2c1n(cc2Br)C(=O)OC(C)(C)C
Complexity: 404
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 3.8
CatalogNumber:
AI61238
ChemicalName:
1-Boc-3-bromo-7-nitroindole
CasNumber:
914349-37-4
MolecularFormula:
C13H13BrN2O4
MolecularWeight:
341.15731999999997
MdlNumber:
MFCD05864785
Smiles:
[O-][N+](=O)c1cccc2c1n(cc2Br)C(=O)OC(C)(C)C
Complexity:
404
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
3.8
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Smiles: Brc1cn(c2c1cccc2OCc1ccccc1)C(=O)OC(C)(C)C
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Brc1cn(c2c1cccc2OCc1ccccc1)C(=O)OC(C)(C)C
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Smiles: OCc1ccccc1n1ccnc1C
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OCc1ccccc1n1ccnc1C
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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