ChemicalBook--->CAS DataBase List--->42711-75-1

42711-75-1

42711-75-1 Structure

42711-75-1 Structure
IdentificationMore
[Name]

3-HYDROXYADAMANTANE-1-CARBOXYLIC ACID
[CAS]

42711-75-1
[Synonyms]

1-HYDROXYADAMANTANE-3-CARBOXYLIC ACID
3-HYDROXYADAMANTANCARBOXYLIC ACID
3-HYDROXYADAMANTANE-1-CARBOXYLIC ACID
3-HYDROXYADAMANTANECARBOXYLIC ACID
AKOS BC-0508
TIMTEC-BB SBB010113
3-Hydroxy-1-Adamantanecarboxylic Acid
3-Hydroxy--1-Amantane Carboxylic Acid
[Molecular Formula]

C11H16O3
[MDL Number]

MFCD00193929
[Molecular Weight]

196.24
[MOL File]

42711-75-1.mol
Chemical PropertiesBack Directory
[Melting point ]

203 °C
[Boiling point ]

357.2±25.0 °C(Predicted)
[density ]

1.419±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

4.60±0.40(Predicted)
[color ]

Off-White
[InChI]

InChI=1S/C11H16O3/c12-9(13)10-2-7-1-8(3-10)5-11(14,4-7)6-10/h7-8,14H,1-6H2,(H,12,13)
[InChIKey]

CJJMAWPEZKYJAP-UHFFFAOYSA-N
[SMILES]

C12(C(O)=O)CC3CC(CC(O)(C3)C1)C2
[CAS DataBase Reference]

42711-75-1(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29181990
Hazard InformationBack Directory
[Chemical Properties]

White to yellow solid
[Uses]

1-Carboxy-3-adamantanol is used in the synthesis of potent pyridyl amide/sulfonamide inhibitors of 11β-HSD-1 which could be applied to a treatment of ulcers or in hormone therapy treatments relating to cortisol.
[Uses]

3-Hydroxy-1-AdaMantane Carboxylic Acid is used in the synthesis of potent pyridyl amide/sulfonamide inhibitors of 11β-HSD-1 which could be applied to a treatment of ulcers or in hormone therapy treatments relating t o cortisol.
[Synthesis Reference(s)]

Synthetic Communications, 18, p. 1967, 1988 DOI: 10.1080/00397918808068263
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-hydroxyadamantane-1-carboxylic acid(42711-75-1)
[Alfa Aesar]

3-Hydroxyadamantane-1-carboxylic acid, 98%(42711-75-1)
[Sigma Aldrich]

42711-75-1(sigmaaldrich)
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