AI56867
83725-77-3 | 5-(2-Chlorophenyl)-3H-1,3,4-oxadiazol-2-one
Manufacturer: A2B Chem
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CatalogNumber
AI56867
ChemicalName
5-(2-Chlorophenyl)-3H-1,3,4-oxadiazol-2-one
CasNumber
83725-77-3
MolecularFormula
C8H5ClN2O2
MolecularWeight
196.5905
MdlNumber
MFCD11046700
Smiles
Clc1ccccc1c1n[nH]c(=O)o1
NscNumber
525345
Complexity
255
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AI56867
ChemicalName: 5-(2-Chlorophenyl)-3H-1,3,4-oxadiazol-2-one
CasNumber: 83725-77-3
MolecularFormula: C8H5ClN2O2
MolecularWeight: 196.5905
MdlNumber: MFCD11046700
Smiles: Clc1ccccc1c1n[nH]c(=O)o1
NscNumber: 525345
Complexity: 255
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AI56867
ChemicalName:
5-(2-Chlorophenyl)-3H-1,3,4-oxadiazol-2-one
CasNumber:
83725-77-3
MolecularFormula:
C8H5ClN2O2
MolecularWeight:
196.5905
MdlNumber:
MFCD11046700
Smiles:
Clc1ccccc1c1n[nH]c(=O)o1
NscNumber:
525345
Complexity:
255
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: AI56868
ChemicalName: 5-(2-Nitrophenyl)-3H-1,3,4-oxadiazol-2-one
CasNumber: 83725-79-5
MolecularFormula: C8H5N3O4
MolecularWeight: 207.143
MdlNumber: MFCD19673273
Smiles: [O-][N+](=O)c1ccccc1c1n[nH]c(=O)o1
NscNumber: 225244
Complexity: 322
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.3
CatalogNumber:
AI56868
ChemicalName:
5-(2-Nitrophenyl)-3H-1,3,4-oxadiazol-2-one
CasNumber:
83725-79-5
MolecularFormula:
C8H5N3O4
MolecularWeight:
207.143
MdlNumber:
MFCD19673273
Smiles:
[O-][N+](=O)c1ccccc1c1n[nH]c(=O)o1
NscNumber:
225244
Complexity:
322
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.3
CatalogNumber: AI56869
ChemicalName: 5-(3-Nitrophenyl)-3H-1,3,4-oxadiazol-2-one
CasNumber: 83725-80-8
MolecularFormula: C8H5N3O4
MolecularWeight: 207.143
MdlNumber: MFCD19288871
Smiles: [O-][N+](=O)c1cccc(c1)c1n[nH]c(=O)o1
NscNumber: __
Complexity: 322
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.3
CatalogNumber:
AI56869
ChemicalName:
5-(3-Nitrophenyl)-3H-1,3,4-oxadiazol-2-one
CasNumber:
83725-80-8
MolecularFormula:
C8H5N3O4
MolecularWeight:
207.143
MdlNumber:
MFCD19288871
Smiles:
[O-][N+](=O)c1cccc(c1)c1n[nH]c(=O)o1
NscNumber:
__
Complexity:
322
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCS(=O)(=N)CC[C@@H](C(=O)O)N
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCS(=O)(=N)CC[C@@H](C(=O)O)N
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__