AC89333
941294-58-2 | tert-Butyl 6-bromonicotinate
Manufacturer: A2B Chem
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CatalogNumber
AC89333
ChemicalName
tert-Butyl 6-bromonicotinate
CasNumber
941294-58-2
MolecularFormula
C10H12BrNO2
MolecularWeight
258.1118
MdlNumber
MFCD09264580
Smiles
Brc1ccc(cn1)C(=O)OC(C)(C)C
Complexity
213
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
2.7
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CatalogNumber: AC89333
ChemicalName: tert-Butyl 6-bromonicotinate
CasNumber: 941294-58-2
MolecularFormula: C10H12BrNO2
MolecularWeight: 258.1118
MdlNumber: MFCD09264580
Smiles: Brc1ccc(cn1)C(=O)OC(C)(C)C
Complexity: 213
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.7
CatalogNumber:
AC89333
ChemicalName:
tert-Butyl 6-bromonicotinate
CasNumber:
941294-58-2
MolecularFormula:
C10H12BrNO2
MolecularWeight:
258.1118
MdlNumber:
MFCD09264580
Smiles:
Brc1ccc(cn1)C(=O)OC(C)(C)C
Complexity:
213
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1cnc(o1)NC(=O)OC(C)(C)C
Complexity: 313
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1cnc(o1)NC(=O)OC(C)(C)C
Complexity:
313
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.8
CatalogNumber: AC89335
ChemicalName: 7-Chloro-4-methylindole
CasNumber: 941294-27-5
MolecularFormula: C9H8ClN
MolecularWeight: 165.6195
MdlNumber: MFCD09475838
Smiles: Cc1ccc(c2c1cc[nH]2)Cl
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3
CatalogNumber:
AC89335
ChemicalName:
7-Chloro-4-methylindole
CasNumber:
941294-27-5
MolecularFormula:
C9H8ClN
MolecularWeight:
165.6195
MdlNumber:
MFCD09475838
Smiles:
Cc1ccc(c2c1cc[nH]2)Cl
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3
CatalogNumber: AC89336
ChemicalName: t-Butyl 4-chloro-2-fluorobenzoate
CasNumber: 941294-14-0
MolecularFormula: C11H12ClFO2
MolecularWeight: 230.6632
MdlNumber: MFCD09475908
Smiles: Clc1ccc(c(c1)F)C(=O)OC(C)(C)C
Complexity: 237
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 3.5
CatalogNumber:
AC89336
ChemicalName:
t-Butyl 4-chloro-2-fluorobenzoate
CasNumber:
941294-14-0
MolecularFormula:
C11H12ClFO2
MolecularWeight:
230.6632
MdlNumber:
MFCD09475908
Smiles:
Clc1ccc(c(c1)F)C(=O)OC(C)(C)C
Complexity:
237
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
3.5