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CAS Number: 7516-33-8
1,2,5-trimethylpiperidin-4-one

Structure

1,2,5-trimethylpiperidin-4-one
Name: 1,2,5-trimethylpiperidin-4-one
Synonyms:
General Information
Product Number: 7516338
CAS Number:
7516-33-8
Name:
4-Piperidinone, 1,2,5-trimethyl-
4-Piperidone, 1,2,5-trimethyl- (6CI,8CI); 1,2,5-Trimethyl-4-piperidinone; 1,2,5-Trimethyl-4-piperidone
 
Chemical Formula: C8H15NO
Exact Mass: 141.12
Molecular Weight: 141.21
m/z: 141.12 (100.0%), 142.12 (8.9%)
Elemental Analysis: C, 68.04; H, 10.71; N, 9.92; O, 11.33
 
InChI: InChI=1S/C8H15NO/c1-6-5-9(3)7(2)4-8(6)10/h6-7H,4-5H2,1-3H3
InChIKey: VQHHMWWQNKUPKH-UHFFFAOYSA-N
Canonical SMILES : CC1CC(=O)C(CN1C)C
 
 
Thermal Properties Value Condition Note
Boiling Point 89-90 °C Press: 20 Torr (1)IC
Boiling Point 82-85 °C Press: 13 Torr (2)CAS
Boiling Point 78 °C Press: 10 Torr (3)CAS
Boiling Point 74-75 °C Press: 8 Torr (4)CAS
Boiling Point 65-68 °C Press: 5 Torr (5)IC
Boiling Point 52-55 °C Press: 3 Torr (6)IC
Boiling Point 49-59 °C Press: 3 Torr (7)IC
Boiling Point 49 °C Press: 3 Torr (8)IC

Specification

98%

References
  1. (1) Praliev, K. D.; Khimiko-Farmatsevticheskii Zhurnal 1983, V17(12), P1490-2 CAPLUS
  2. (2) Nazarov, I. N.; Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya 1949, P504-21 CAPLUS
  3. (3) Nazarov, I. N.; Zhurnal Obshchei Khimii 1953, V23, P1990-4 CAPLUS
  4. (4) Nazarov, I. N.; Zhurnal Obshchei Khimii 1952, V22, P623-32 CAPLUS
  5. (5) Tosunyan, A. O.; Armyanskii Khimicheskii Zhurnal 1981, V34(2), P138-41 CAPLUS
  6. (6) Makin, S. M.; Zhurnal Organicheskoi Khimii 1991, V27(2), P312-17 CAPLUS
  7. (7) Prostakov, N. S.; Izvestiya Vysshikh Uchebnykh Zavedenii, Khimiya i Khimicheskaya Tekhnologiya 1981, V24(12), P1490-4 CAPLUS
  8. (8) Sokolov, D. V.; Izvestiya Akademii Nauk Kazakhskoi SSR, Seriya Khimicheskaya 1977, V27(5), P82-5 CAPLUS
  9. (9) ACD: Spectral data were obtained from Advanced Chemistry Development, Inc.
  10. (10) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
  11. (11) Makin, S. M.; Khimiko-Farmatsevticheskii Zhurnal 1989, V23(12), P1493-5 CAPLUS
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