AE62472
1261976-44-6 | 4-(3-Carboxyphenyl)-2-methylphenol
Manufacturer: A2B Chem
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CatalogNumber
AE62472
ChemicalName
4-(3-Carboxyphenyl)-2-methylphenol
CasNumber
1261976-44-6
MolecularFormula
C14H12O3
MolecularWeight
228.2433
MdlNumber
MFCD18313223
Smiles
OC(=O)c1cccc(c1)c1ccc(c(c1)C)O
Complexity
277
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
3.1
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CatalogNumber: AE62472
ChemicalName: 4-(3-Carboxyphenyl)-2-methylphenol
CasNumber: 1261976-44-6
MolecularFormula: C14H12O3
MolecularWeight: 228.2433
MdlNumber: MFCD18313223
Smiles: OC(=O)c1cccc(c1)c1ccc(c(c1)C)O
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 3.1
CatalogNumber:
AE62472
ChemicalName:
4-(3-Carboxyphenyl)-2-methylphenol
CasNumber:
1261976-44-6
MolecularFormula:
C14H12O3
MolecularWeight:
228.2433
MdlNumber:
MFCD18313223
Smiles:
OC(=O)c1cccc(c1)c1ccc(c(c1)C)O
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
3.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Oc1cc(Cl)cc(c1)c1csc(c1)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Oc1cc(Cl)cc(c1)c1csc(c1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AE62474
ChemicalName: 4-[4-(Piperidinocarbonyl)phenyl]benzaldehyde
CasNumber: 1393442-40-4
MolecularFormula: C19H19NO2
MolecularWeight: 293.3597
MdlNumber: MFCD22383731
Smiles: O=Cc1ccc(cc1)c1ccc(cc1)C(=O)N1CCCCC1
Complexity: 373
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 3.3
CatalogNumber:
AE62474
ChemicalName:
4-[4-(Piperidinocarbonyl)phenyl]benzaldehyde
CasNumber:
1393442-40-4
MolecularFormula:
C19H19NO2
MolecularWeight:
293.3597
MdlNumber:
MFCD22383731
Smiles:
O=Cc1ccc(cc1)c1ccc(cc1)C(=O)N1CCCCC1
Complexity:
373
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
3.3
CatalogNumber: AE62475
ChemicalName: 3-Chloro-5-(3-cyano-2-fluorophenyl)phenol
CasNumber: 1261960-99-9
MolecularFormula: C13H7ClFNO
MolecularWeight: 247.6522
MdlNumber: MFCD18315556
Smiles: N#Cc1cccc(c1F)c1cc(O)cc(c1)Cl
Complexity: 316
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.6
CatalogNumber:
AE62475
ChemicalName:
3-Chloro-5-(3-cyano-2-fluorophenyl)phenol
CasNumber:
1261960-99-9
MolecularFormula:
C13H7ClFNO
MolecularWeight:
247.6522
MdlNumber:
MFCD18315556
Smiles:
N#Cc1cccc(c1F)c1cc(O)cc(c1)Cl
Complexity:
316
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.6