AB82928
893736-89-5 | 3-[3-(Benzyloxy)phenyl]benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB82928
ChemicalName
3-[3-(Benzyloxy)phenyl]benzonitrile
CasNumber
893736-89-5
MolecularFormula
C20H15NO
MolecularWeight
285.3392
MdlNumber
MFCD06802287
Smiles
N#Cc1cccc(c1)c1cccc(c1)OCc1ccccc1
Complexity
378
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
2
RotatableBondCount
4
Xlogp3
4.7
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CatalogNumber: AB82928
ChemicalName: 3-[3-(Benzyloxy)phenyl]benzonitrile
CasNumber: 893736-89-5
MolecularFormula: C20H15NO
MolecularWeight: 285.3392
MdlNumber: MFCD06802287
Smiles: N#Cc1cccc(c1)c1cccc(c1)OCc1ccccc1
Complexity: 378
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
Xlogp3: 4.7
CatalogNumber:
AB82928
ChemicalName:
3-[3-(Benzyloxy)phenyl]benzonitrile
CasNumber:
893736-89-5
MolecularFormula:
C20H15NO
MolecularWeight:
285.3392
MdlNumber:
MFCD06802287
Smiles:
N#Cc1cccc(c1)c1cccc(c1)OCc1ccccc1
Complexity:
378
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
Xlogp3:
4.7
CatalogNumber: AB82930
ChemicalName: 4'-(Methylsulfonyl)biphenyl-3-carboxylic acid
CasNumber: 893736-70-4
MolecularFormula: C14H12O4S
MolecularWeight: 276.3077
MdlNumber: MFCD06802570
Smiles: OC(=O)c1cccc(c1)c1ccc(cc1)S(=O)(=O)C
Complexity: 415
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 2.3
CatalogNumber:
AB82930
ChemicalName:
4'-(Methylsulfonyl)biphenyl-3-carboxylic acid
CasNumber:
893736-70-4
MolecularFormula:
C14H12O4S
MolecularWeight:
276.3077
MdlNumber:
MFCD06802570
Smiles:
OC(=O)c1cccc(c1)c1ccc(cc1)S(=O)(=O)C
Complexity:
415
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
2.3
CatalogNumber: AB82931
ChemicalName: Methyl 3-(6-methoxypyridin-3-yl)benzoate
CasNumber: 893736-60-2
MolecularFormula: C14H13NO3
MolecularWeight: 243.2579
MdlNumber: MFCD06801890
Smiles: COc1ccc(cn1)c1cccc(c1)C(=O)OC
Complexity: 282
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 2.6
CatalogNumber:
AB82931
ChemicalName:
Methyl 3-(6-methoxypyridin-3-yl)benzoate
CasNumber:
893736-60-2
MolecularFormula:
C14H13NO3
MolecularWeight:
243.2579
MdlNumber:
MFCD06801890
Smiles:
COc1ccc(cn1)c1cccc(c1)C(=O)OC
Complexity:
282
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
2.6
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Smiles: O=Cc1ccc(cc1)c1ccc2c(c1)ccc(n2)C
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O=Cc1ccc(cc1)c1ccc2c(c1)ccc(n2)C
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HydrogenBondAcceptorCount:
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