AI56378
78338-67-7 | 4-(2-Methoxyphenoxy)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AI56378
ChemicalName
4-(2-Methoxyphenoxy)benzonitrile
CasNumber
78338-67-7
MolecularFormula
C14H11NO2
MolecularWeight
225.2426
MdlNumber
MFCD09705472
Smiles
COc1ccccc1Oc1ccc(cc1)C#N
Complexity
275
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
2.6
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CatalogNumber: AI56378
ChemicalName: 4-(2-Methoxyphenoxy)benzonitrile
CasNumber: 78338-67-7
MolecularFormula: C14H11NO2
MolecularWeight: 225.2426
MdlNumber: MFCD09705472
Smiles: COc1ccccc1Oc1ccc(cc1)C#N
Complexity: 275
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.6
CatalogNumber:
AI56378
ChemicalName:
4-(2-Methoxyphenoxy)benzonitrile
CasNumber:
78338-67-7
MolecularFormula:
C14H11NO2
MolecularWeight:
225.2426
MdlNumber:
MFCD09705472
Smiles:
COc1ccccc1Oc1ccc(cc1)C#N
Complexity:
275
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)[C@@H](CC#C)N
Complexity: 144
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: -0.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)[C@@H](CC#C)N
Complexity:
144
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
-0.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COCCOc1ccc(c(c1)C(=O)O)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COCCOc1ccc(c(c1)C(=O)O)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [C-]#[N+]CCN(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[C-]#[N+]CCN(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__