AI30871
1342016-50-5 | 5-(4-Chloro-2-fluorophenyl)-3H-1,3,4-oxadiazol-2-one
Manufacturer: A2B Chem
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CatalogNumber
AI30871
ChemicalName
5-(4-Chloro-2-fluorophenyl)-3H-1,3,4-oxadiazol-2-one
CasNumber
1342016-50-5
MolecularFormula
C8H4ClFN2O2
MolecularWeight
214.581
MdlNumber
MFCD19673382
Smiles
Clc1ccc(c(c1)F)c1n[nH]c(=O)o1
Complexity
285
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.2
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CatalogNumber: AI30871
ChemicalName: 5-(4-Chloro-2-fluorophenyl)-3H-1,3,4-oxadiazol-2-one
CasNumber: 1342016-50-5
MolecularFormula: C8H4ClFN2O2
MolecularWeight: 214.581
MdlNumber: MFCD19673382
Smiles: Clc1ccc(c(c1)F)c1n[nH]c(=O)o1
Complexity: 285
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.2
CatalogNumber:
AI30871
ChemicalName:
5-(4-Chloro-2-fluorophenyl)-3H-1,3,4-oxadiazol-2-one
CasNumber:
1342016-50-5
MolecularFormula:
C8H4ClFN2O2
MolecularWeight:
214.581
MdlNumber:
MFCD19673382
Smiles:
Clc1ccc(c(c1)F)c1n[nH]c(=O)o1
Complexity:
285
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.2
CatalogNumber: AI30872
ChemicalName: 2-(Cyclopropylmethoxy)-5-fluorobenzonitrile
CasNumber: 1342025-16-4
MolecularFormula: C11H10FNO
MolecularWeight: 191.2016
MdlNumber: MFCD18860667
Smiles: N#Cc1cc(F)ccc1OCC1CC1
Complexity: 243
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 2.5
CatalogNumber:
AI30872
ChemicalName:
2-(Cyclopropylmethoxy)-5-fluorobenzonitrile
CasNumber:
1342025-16-4
MolecularFormula:
C11H10FNO
MolecularWeight:
191.2016
MdlNumber:
MFCD18860667
Smiles:
N#Cc1cc(F)ccc1OCC1CC1
Complexity:
243
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1n[nH]c2c1CS(=O)(=O)CC2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1n[nH]c2c1CS(=O)(=O)CC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C#CCC(c1cccc(c1)Br)(O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C#CCC(c1cccc(c1)Br)(O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__