AI50390
433226-25-6 | 2-(Benzyloxy)-1-fluoro-4-nitrobenzene
Manufacturer: A2B Chem
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CatalogNumber
AI50390
ChemicalName
2-(Benzyloxy)-1-fluoro-4-nitrobenzene
CasNumber
433226-25-6
MolecularFormula
C13H10FNO3
MolecularWeight
247.2218
MdlNumber
MFCD27935905
Smiles
Fc1ccc(cc1OCc1ccccc1)[N+](=O)[O-]
Complexity
276
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
3.3
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CatalogNumber: AI50390
ChemicalName: 2-(Benzyloxy)-1-fluoro-4-nitrobenzene
CasNumber: 433226-25-6
MolecularFormula: C13H10FNO3
MolecularWeight: 247.2218
MdlNumber: MFCD27935905
Smiles: Fc1ccc(cc1OCc1ccccc1)[N+](=O)[O-]
Complexity: 276
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 3.3
CatalogNumber:
AI50390
ChemicalName:
2-(Benzyloxy)-1-fluoro-4-nitrobenzene
CasNumber:
433226-25-6
MolecularFormula:
C13H10FNO3
MolecularWeight:
247.2218
MdlNumber:
MFCD27935905
Smiles:
Fc1ccc(cc1OCc1ccccc1)[N+](=O)[O-]
Complexity:
276
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
3.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC1=C(C(=CC(=C1)C=NO)Cl)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC1=C(C(=CC(=C1)C=NO)Cl)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI50392
ChemicalName: 2-Cyclohexylmandelic acid
CasNumber: 4335-77-7
MolecularFormula: C14H18O3
MolecularWeight: 234.29092000000006
MdlNumber: MFCD00194543
Smiles: OC(=O)C(c1ccccc1)(C1CCCCC1)O
Complexity: 265
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 3
CatalogNumber:
AI50392
ChemicalName:
2-Cyclohexylmandelic acid
CasNumber:
4335-77-7
MolecularFormula:
C14H18O3
MolecularWeight:
234.29092000000006
MdlNumber:
MFCD00194543
Smiles:
OC(=O)C(c1ccccc1)(C1CCCCC1)O
Complexity:
265
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#CCc1cc(cc(c1)Cl)OC(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#CCc1cc(cc(c1)Cl)OC(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__