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CAS Number: 20098-14-0
5-hydroxyadamantan-2-one

Structure

5-hydroxyadamantan-2-one
Name: 5-hydroxyadamantan-2-one
Synonyms:
General Information
Product Number: 20098140

CAS Registry Number 20098-14-0
Name:
Tricyclo[3.3.1.13,?7]?decan-?2-?one, 5-?hydroxy-
2-Adamantanone, 5-hydroxy- (8CI)
Tricyclo[3.3.1.13,7]decanone, 5-hydroxy- (9CI)
1-Hydroxy-4-adamantanone
1-Hydroxy-4-ketoadamantane
4-Oxo-1-adamantanol

 

Chemical Formula: C10H14O2
Exact Mass: 166.10
Molecular Weight: 166.22
m/z: 166.10 (100.0%), 167.10 (10.9%)

 

InChI:InChI=1S/C10H14O2/c11-9-7-1-6-2-8(9)5-10(12,3-6)4-7/h6-8,12H,1-5H2

InChI Key:TZBDEVBNMSLVKT-UHFFFAOYSA-N

Canonical SMILES:C1C2CC3CC(C2)(CC1C3=O)O

 

Thermal Properties Value Condition Note
Melting Point 331-332.5 °C Solv: carbon tetrachloride (56-23-5) (4)IC
Melting Point 320-321 °C   (3)CAS
Melting Point 319-322 °C Solv: carbon tetrachloride (56-23-5) (3)CAS
Melting Point 318 °C   (7)CAS
Melting Point >250 °C (sublm)   (8)IC
Melting Point 200 °C   (9)CAS
Melting Point See full text   (10)CAS

Specification

98%

References
  1. (3) Khusnutdinov, R. I.; Russian Journal of Organic Chemistry 2009, V45(8), P1137-1142 CAPLUS
  2. (4) Vodicka, Ludek; Sbornik Vysoke Skoly Chemicko-Technologicke v Praze, D: Technologie Paliv 1978, VD 39, P357-68 CAPLUS
  3. (7) Zefirova, O. N.; Russian Journal of Organic Chemistry (Translation of Zhurnal Organicheskoi Khimii) 2002, V38(8), P1125-1129 CAPLUS
  4. (8) Morat, Claude; Tetrahedron Letters 1979, (45), P4409-10 CAPLUS
  5. (9) Takahashi, Hyou; US 20040248035 A1 2004 CAPLUS
  6. (10) Geluk, H. W.; Tetrahedron 1968, V24(15), P5369-77 CAPLUS
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