AA36215
1261896-62-1 | 5-(3-Cyanophenyl)-3-methylphenol
Manufacturer: A2B Chem
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CatalogNumber
AA36215
ChemicalName
5-(3-Cyanophenyl)-3-methylphenol
CasNumber
1261896-62-1
MolecularFormula
C14H11NO
MolecularWeight
209.2432
MdlNumber
MFCD18313106
Smiles
N#Cc1cccc(c1)c1cc(C)cc(c1)O
Complexity
280
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3.3
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CatalogNumber: AA36215
ChemicalName: 5-(3-Cyanophenyl)-3-methylphenol
CasNumber: 1261896-62-1
MolecularFormula: C14H11NO
MolecularWeight: 209.2432
MdlNumber: MFCD18313106
Smiles: N#Cc1cccc(c1)c1cc(C)cc(c1)O
Complexity: 280
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.3
CatalogNumber:
AA36215
ChemicalName:
5-(3-Cyanophenyl)-3-methylphenol
CasNumber:
1261896-62-1
MolecularFormula:
C14H11NO
MolecularWeight:
209.2432
MdlNumber:
MFCD18313106
Smiles:
N#Cc1cccc(c1)c1cc(C)cc(c1)O
Complexity:
280
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.3
CatalogNumber: AA36216
ChemicalName: 2-(4-Trifluoromethoxyphenyl)phenol
CasNumber: 1261896-51-8
MolecularFormula: C13H9F3O2
MolecularWeight: 254.2046
MdlNumber: MFCD18312995
Smiles: Oc1ccccc1c1ccc(cc1)OC(F)(F)F
Complexity: 260
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 4.3
CatalogNumber:
AA36216
ChemicalName:
2-(4-Trifluoromethoxyphenyl)phenol
CasNumber:
1261896-51-8
MolecularFormula:
C13H9F3O2
MolecularWeight:
254.2046
MdlNumber:
MFCD18312995
Smiles:
Oc1ccccc1c1ccc(cc1)OC(F)(F)F
Complexity:
260
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
4.3
CatalogNumber: AA36217
ChemicalName: 4-[3-(N,N-Dimethylaminocarbonyl)phenyl]phenol
CasNumber: 1261896-44-9
MolecularFormula: C15H15NO2
MolecularWeight: 241.2851
MdlNumber: MFCD18312956
Smiles: Oc1ccc(cc1)c1cccc(c1)C(=O)N(C)C
Complexity: 282
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AA36217
ChemicalName:
4-[3-(N,N-Dimethylaminocarbonyl)phenyl]phenol
CasNumber:
1261896-44-9
MolecularFormula:
C15H15NO2
MolecularWeight:
241.2851
MdlNumber:
MFCD18312956
Smiles:
Oc1ccc(cc1)c1cccc(c1)C(=O)N(C)C
Complexity:
282
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.7
CatalogNumber: AA36218
ChemicalName: 2-(4-Fluoro-3-methoxyphenyl)phenol
CasNumber: 1261896-42-7
MolecularFormula: C13H11FO2
MolecularWeight: 218.2236
MdlNumber: MFCD18312865
Smiles: COc1cc(ccc1F)c1ccccc1O
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.3
CatalogNumber:
AA36218
ChemicalName:
2-(4-Fluoro-3-methoxyphenyl)phenol
CasNumber:
1261896-42-7
MolecularFormula:
C13H11FO2
MolecularWeight:
218.2236
MdlNumber:
MFCD18312865
Smiles:
COc1cc(ccc1F)c1ccccc1O
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.3