AG20637
53059-31-7 | 1-Methoxy-4-(3-nitrophenyl)benzene
Manufacturer: A2B Chem
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CatalogNumber
AG20637
ChemicalName
1-Methoxy-4-(3-nitrophenyl)benzene
CasNumber
53059-31-7
MolecularFormula
C13H11NO3
MolecularWeight
229.2313
MdlNumber
MFCD08669842
Smiles
COc1ccc(cc1)c1cccc(c1)[N+](=O)[O-]
Complexity
256
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
3.8
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CatalogNumber: AG20637
ChemicalName: 1-Methoxy-4-(3-nitrophenyl)benzene
CasNumber: 53059-31-7
MolecularFormula: C13H11NO3
MolecularWeight: 229.2313
MdlNumber: MFCD08669842
Smiles: COc1ccc(cc1)c1cccc(c1)[N+](=O)[O-]
Complexity: 256
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 3.8
CatalogNumber:
AG20637
ChemicalName:
1-Methoxy-4-(3-nitrophenyl)benzene
CasNumber:
53059-31-7
MolecularFormula:
C13H11NO3
MolecularWeight:
229.2313
MdlNumber:
MFCD08669842
Smiles:
COc1ccc(cc1)c1cccc(c1)[N+](=O)[O-]
Complexity:
256
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
3.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C1CCc2c(C1)ccc(c2)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C1CCc2c(C1)ccc(c2)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1cncc2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1cncc2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AG20640
ChemicalName: 5-Nitro-1,3-dihydroisobenzofuran
CasNumber: 52771-99-0
MolecularFormula: C8H7NO3
MolecularWeight: 165.1461
MdlNumber: MFCD09842489
Smiles: [O-][N+](=O)c1ccc2c(c1)COC2
Complexity: 189
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: __
Xlogp3: 1
CatalogNumber:
AG20640
ChemicalName:
5-Nitro-1,3-dihydroisobenzofuran
CasNumber:
52771-99-0
MolecularFormula:
C8H7NO3
MolecularWeight:
165.1461
MdlNumber:
MFCD09842489
Smiles:
[O-][N+](=O)c1ccc2c(c1)COC2
Complexity:
189
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
__
Xlogp3:
1