| Identification | Back Directory | [Name]
4-(4-Chlorophenyl)cyclohexanecarboxylic acid | [CAS]
49708-81-8 | [Synonyms]
Atovaquone Impurity 8
Atovaquone Impurity 2
Atovaquone Impurity 19
4-(4-Chlorophenyl)cyclohexanecarboxylic
4-(4-Chlorophenyl)cyclohexanecarboxylic acid
4-(4-CHLOROPHENYL)CYCLOHENXANECARBOXYLICACID
TRANS-4-(4-CHLOROPHENYL)CYCLOHEXANECARBOXYLIC
4-(CHLOROPHENYL) CYCLOHEXANE-1-CARBOXYLIC ACID
4-(p-Chlorophenyl)-1-cyclohexanecarboxylic acid
TRANS-4-(4-CHLOROPHENYL)CYCLOHEXANECARBOXYLIC ACID
(1r,4r)-4-(4-Chlorophenyl)cyclohexanecarboxylic acid
Cyclohexanecarboxylic acid, 4-(4-chlorophenyl)-,trans-
TRANS]-4-(4-CHLOROPHENYL)-CYCLOHEXANE-1-CARBOXYLIC ACID
trans-4-(4-Chlorophenyl)cyclohexane-1-carboxylicacid,98%
TRANS-4-(4-CHLOROPHENYL)CYCLOHEXANECARBOXYLIC ACID (ATOVAQUONE INTERMEDIATE)/ 49708-81-8
1-Chloro-4-(trans-4-carboxycyclohex-1-yl)benzene, trans-1-Carboxy-4-(4-chlorophenyl)cyclohexane | [EINECS(EC#)]
212-512-3 | [Molecular Formula]
C13H15ClO2 | [MDL Number]
MFCD06797626 | [MOL File]
49708-81-8.mol | [Molecular Weight]
238.71 |
| Chemical Properties | Back Directory | [Melting point ]
252-254 °C | [Boiling point ]
387.1±42.0 °C(Predicted) | [density ]
1.225±0.06 g/cm3(Predicted) | [storage temp. ]
Sealed in dry,Room Temperature | [solubility ]
Chloroform (Slightly, Sonicated), DMSO (Slightly), Methanol (Slightly, Sonicated) | [form ]
Solid | [pka]
4.80±0.10(Predicted) | [color ]
White to Off-White | [InChI]
InChI=1S/C13H15ClO2/c14-12-7-5-10(6-8-12)9-1-3-11(4-2-9)13(15)16/h5-9,11H,1-4H2,(H,15,16)/t9-,11- | [InChIKey]
NXXDIEYTMQYWJU-HOMQSWHASA-N | [SMILES]
[C@@H]1(C(O)=O)CC[C@@H](C2=CC=C(Cl)C=C2)CC1 |
| Hazard Information | Back Directory | [Chemical Properties]
off-white powder | [Uses]
trans-4-(4-Chlorophenyl)cyclohexanecarboxylic Acid is an impurity of Atovaquone (A793500), which is a hydroxynaphthoquinone derivative that inhibits mitochondrial electron transport and possess antipneumocystic activity. |
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