AA33890
1201-68-9 | 3-(Chloromethyl)-5-phenyl-1,2,4-oxadiazole
Manufacturer: A2B Chem
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CatalogNumber
AA33890
ChemicalName
3-(Chloromethyl)-5-phenyl-1,2,4-oxadiazole
CasNumber
1201-68-9
MolecularFormula
C9H7ClN2O
MolecularWeight
194.6177
MdlNumber
MFCD00084968
Smiles
ClCc1noc(n1)c1ccccc1
NscNumber
184821
Complexity
162
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
2.2
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CatalogNumber: AA33890
ChemicalName: 3-(Chloromethyl)-5-phenyl-1,2,4-oxadiazole
CasNumber: 1201-68-9
MolecularFormula: C9H7ClN2O
MolecularWeight: 194.6177
MdlNumber: MFCD00084968
Smiles: ClCc1noc(n1)c1ccccc1
NscNumber: 184821
Complexity: 162
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 2.2
CatalogNumber:
AA33890
ChemicalName:
3-(Chloromethyl)-5-phenyl-1,2,4-oxadiazole
CasNumber:
1201-68-9
MolecularFormula:
C9H7ClN2O
MolecularWeight:
194.6177
MdlNumber:
MFCD00084968
Smiles:
ClCc1noc(n1)c1ccccc1
NscNumber:
184821
Complexity:
162
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClCC(=O)c1cc(Cl)c(cc1Cl)Cl
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClCC(=O)c1cc(Cl)c(cc1Cl)Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA33894
ChemicalName: 1-(2,5-Dimethoxyphenyl)ethanone
CasNumber: 1201-38-3
MolecularFormula: C10H12O3
MolecularWeight: 180.20047999999997
MdlNumber: MFCD00008728
Smiles: COc1ccc(c(c1)C(=O)C)OC
NscNumber: 62094
Complexity: 179
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 1.8
CatalogNumber:
AA33894
ChemicalName:
1-(2,5-Dimethoxyphenyl)ethanone
CasNumber:
1201-38-3
MolecularFormula:
C10H12O3
MolecularWeight:
180.20047999999997
MdlNumber:
MFCD00008728
Smiles:
COc1ccc(c(c1)C(=O)C)OC
NscNumber:
62094
Complexity:
179
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
1.8
CatalogNumber: AA33895
ChemicalName: 2,3,4,5-tetrafluorobenzoic acid
CasNumber: 1201-31-6
MolecularFormula: C7H2F4O2
MolecularWeight: 194.0832
MdlNumber: MFCD00009613
Smiles: OC(=O)c1cc(F)c(c(c1F)F)F
NscNumber: 168728
Complexity: 211
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 6
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AA33895
ChemicalName:
2,3,4,5-tetrafluorobenzoic acid
CasNumber:
1201-31-6
MolecularFormula:
C7H2F4O2
MolecularWeight:
194.0832
MdlNumber:
MFCD00009613
Smiles:
OC(=O)c1cc(F)c(c(c1F)F)F
NscNumber:
168728
Complexity:
211
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
6
RotatableBondCount:
1
Xlogp3:
1.8