| Identification | More | [Name]
1-Adamantaneacetic acid | [CAS]
4942-47-6 | [Synonyms]
1-ADAMANTANEACETIC ACID
1-ADAMANTYLACETIC ACID
1-CARBOXYMETHYLADAMANTANE
2-(1-ADAMANTYL)ACETIC ACID
ADAMANTYL ACETIC ACID
AKOS B019591
AKOS BBS-00006339
AKOS MSC-0706
CHEMBRDG-BB 4013929
IFLAB-BB F1928-0005
LABOTEST-BB LT00007833
RARECHEM AQ TC 1008
tricyclo[3.3.1.13,7]dec-1-ylacetic acid
Tricyclo[3.3.1.1(3,7)-]decane-1-acetic acid
1-carboymethyl adamantane
1-Adamantaneaceticacid,98+%
1-ADAMANTANEACETIC ACID 99+%
1-ADAMANTANEACETIC ACID PURUM 98%
1-ADAMANTANEACETIC ACID (1-ADAMANTYLACETIC ACID)
1-carbonylmethyladamantane | [EINECS(EC#)]
225-585-1 | [Molecular Formula]
C12H18O2 | [MDL Number]
MFCD00074728 | [Molecular Weight]
194.27 | [MOL File]
4942-47-6.mol |
| Chemical Properties | Back Directory | [Appearance]
white to off-white crystalline powder or crystals | [Melting point ]
134-137 °C (lit.) | [Boiling point ]
270.73°C (rough estimate) | [density ]
1.0086 (rough estimate) | [refractive index ]
1.4949 (estimate) | [storage temp. ]
Sealed in dry,Room Temperature | [solubility ]
Solubility in Methanol - almost transparency | [form ]
Crystalline Powder or Crystals | [pka]
5.00±0.10(Predicted) | [color ]
White to off-white | [BRN ]
641412 | [InChIKey]
AOTQGWFNFTVXNQ-UHFFFAOYSA-N | [CAS DataBase Reference]
4942-47-6(CAS DataBase Reference) | [NIST Chemistry Reference]
1-Adamantaneacetic acid(4942-47-6) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi,Xn,F | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin .
R15:Contact with water liberates extremely flammable gases.
R10:Flammable. | [Safety Statements ]
S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
S43:In case of fire, use ... (indicate in the space the precise type of fire-fighting equipment. If water increases the risk add-Never use water) .
S7/8:Keep container tightly closed and dry . | [WGK Germany ]
3
| [TSCA ]
Yes | [HazardClass ]
IRRITANT | [HS Code ]
29162090 |
| Hazard Information | Back Directory | [Chemical Properties]
white to off-white crystalline powder or crystals | [Uses]
1-Adamantaneacetic acid was used as an acylating agent in determining pharmacological characteristics of ten new analogues of bradykinin (Arg-Pro-Pro-Gly-Phe-Ser-Pro-Phe-Arg) that were modified in the N-terminal part of the molecule. | [Biochem/physiol Actions]
1-Adamantaneacetic acid is an inhibitor of chorismate mutase-prephenate dehydrogenase (EC 1.3.1.12) from Escherichia coli K12 (strain JP 232). | [Purification Methods]
Dissolve the acid in hot NaOH, treat with charcoal, filter and acidify. Collect the solid, wash it with H2O, dry and recrystallise it from
MeOH. [Stetter et al. Chem Ber 92 1629 1959.] The acid chloride [2094-72-6] has M 168.7, m 51-54o,
and b 135-136o/1mm. LACHRYMATORY. |
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