AI56135
76629-46-4 | 3-Methyl-5-(2-nitrophenyl)-1,2,4-oxadiazole
Manufacturer: A2B Chem
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CatalogNumber
AI56135
ChemicalName
3-Methyl-5-(2-nitrophenyl)-1,2,4-oxadiazole
CasNumber
76629-46-4
MolecularFormula
C9H7N3O3
MolecularWeight
205.1702
MdlNumber
MFCD28369608
Smiles
Cc1noc(n1)c1ccccc1[N+](=O)[O-]
Complexity
243
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
RotatableBondCount
1
Xlogp3
2
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CatalogNumber: AI56135
ChemicalName: 3-Methyl-5-(2-nitrophenyl)-1,2,4-oxadiazole
CasNumber: 76629-46-4
MolecularFormula: C9H7N3O3
MolecularWeight: 205.1702
MdlNumber: MFCD28369608
Smiles: Cc1noc(n1)c1ccccc1[N+](=O)[O-]
Complexity: 243
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AI56135
ChemicalName:
3-Methyl-5-(2-nitrophenyl)-1,2,4-oxadiazole
CasNumber:
76629-46-4
MolecularFormula:
C9H7N3O3
MolecularWeight:
205.1702
MdlNumber:
MFCD28369608
Smiles:
Cc1noc(n1)c1ccccc1[N+](=O)[O-]
Complexity:
243
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: CCOC(=O)C(CC1=CC=CC=C1)C2(OCCO2)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CCOC(=O)C(CC1=CC=CC=C1)C2(OCCO2)C
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CC1C(C(C(=O)O1)O)O
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Smiles:
CC1C(C(C(=O)O1)O)O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: OC(=O)C1(CC(=O)C1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C1(CC(=O)C1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__