AA53191
1215206-26-0 | tert-Butyl 2-chloro-5-fluorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AA53191
ChemicalName
tert-Butyl 2-chloro-5-fluorobenzoate
CasNumber
1215206-26-0
MolecularFormula
C11H12ClFO2
MolecularWeight
230.6632
MdlNumber
MFCD15143482
Smiles
O=C(c1cc(F)ccc1Cl)OC(C)(C)C
Complexity
237
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
3.6
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CatalogNumber: AA53191
ChemicalName: tert-Butyl 2-chloro-5-fluorobenzoate
CasNumber: 1215206-26-0
MolecularFormula: C11H12ClFO2
MolecularWeight: 230.6632
MdlNumber: MFCD15143482
Smiles: O=C(c1cc(F)ccc1Cl)OC(C)(C)C
Complexity: 237
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 3.6
CatalogNumber:
AA53191
ChemicalName:
tert-Butyl 2-chloro-5-fluorobenzoate
CasNumber:
1215206-26-0
MolecularFormula:
C11H12ClFO2
MolecularWeight:
230.6632
MdlNumber:
MFCD15143482
Smiles:
O=C(c1cc(F)ccc1Cl)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: COc1ccc(c(c1)Cl)c1cccc(c1)C(=O)O
Complexity: 295
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(c(c1)Cl)c1cccc(c1)C(=O)O
Complexity:
295
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cccc(c1Cl)c1cccc(c1)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cccc(c1Cl)c1cccc(c1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA53194
ChemicalName: 6-(Trifluoromethoxy)quinoxaline, HCl
CasNumber: 1215206-23-7
MolecularFormula: C9H6ClF3N2O
MolecularWeight: 250.6049
MdlNumber: MFCD13195695
Smiles: FC(Oc1ccc2c(c1)nccn2)(F)F.Cl
Complexity: 222
Covalently-bondedUnitCount: 2
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 6
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AA53194
ChemicalName:
6-(Trifluoromethoxy)quinoxaline, HCl
CasNumber:
1215206-23-7
MolecularFormula:
C9H6ClF3N2O
MolecularWeight:
250.6049
MdlNumber:
MFCD13195695
Smiles:
FC(Oc1ccc2c(c1)nccn2)(F)F.Cl
Complexity:
222
Covalently-bondedUnitCount:
2
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
6
RotatableBondCount:
1
Xlogp3:
__