AF59862
375368-94-8 | t-Butyl 3-bromo-4-fluorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AF59862
ChemicalName
t-Butyl 3-bromo-4-fluorobenzoate
CasNumber
375368-94-8
MolecularFormula
C11H12BrFO2
MolecularWeight
275.1142
MdlNumber
MFCD03095011
Smiles
O=C(c1ccc(c(c1)Br)F)OC(C)(C)C
Complexity
237
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
3.6
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CatalogNumber: AF59862
ChemicalName: t-Butyl 3-bromo-4-fluorobenzoate
CasNumber: 375368-94-8
MolecularFormula: C11H12BrFO2
MolecularWeight: 275.1142
MdlNumber: MFCD03095011
Smiles: O=C(c1ccc(c(c1)Br)F)OC(C)(C)C
Complexity: 237
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 3.6
CatalogNumber:
AF59862
ChemicalName:
t-Butyl 3-bromo-4-fluorobenzoate
CasNumber:
375368-94-8
MolecularFormula:
C11H12BrFO2
MolecularWeight:
275.1142
MdlNumber:
MFCD03095011
Smiles:
O=C(c1ccc(c(c1)Br)F)OC(C)(C)C
Complexity:
237
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
3.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1nc2c(s1)cc(cc2)SC(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1nc2c(s1)cc(cc2)SC(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF59864
ChemicalName: 6-Iodo-3,4-dihydronaphthalen-1(2h)-one
CasNumber: 340825-13-0
MolecularFormula: C10H9IO
MolecularWeight: 272.0823
MdlNumber: MFCD09751536
Smiles: Ic1ccc2c(c1)CCCC2=O
Complexity: 190
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
RotatableBondCount: __
Xlogp3: 2.7
CatalogNumber:
AF59864
ChemicalName:
6-Iodo-3,4-dihydronaphthalen-1(2h)-one
CasNumber:
340825-13-0
MolecularFormula:
C10H9IO
MolecularWeight:
272.0823
MdlNumber:
MFCD09751536
Smiles:
Ic1ccc2c(c1)CCCC2=O
Complexity:
190
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
RotatableBondCount:
__
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1COc2c1c(Cl)ccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1COc2c1c(Cl)ccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__