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5090-54-0

5090-54-0 structure
5090-54-0 structure
  • Name: VALERANONE
  • Chemical Name: (7R)-4a,8a-dimethyl-7-propan-2-yl-3,4,5,6,7,8-hexahydro-2H-naphthalen-1-one
  • CAS Number: 5090-54-0
  • Molecular Formula: C15H26O
  • Molecular Weight: 222.36600
  • Create Date: 2016-02-21 01:39:15
  • Modify Date: 2024-08-31 09:26:31

Name (7R)-4a,8a-dimethyl-7-propan-2-yl-3,4,5,6,7,8-hexahydro-2H-naphthalen-1-one
Synonyms (-)-Valeranone
Jatamansone
Molecular Formula C15H26O
Molecular Weight 222.36600
Exact Mass 222.19800
PSA 17.07000
LogP 4.20810

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QK5075000
CHEMICAL NAME :
1(2H)-Naphthalenone, octahydro-7-beta-isopropyl-4a-alpha,8a-alpha-dimethyl -, (-)-
CAS REGISTRY NUMBER :
5090-54-0
LAST UPDATED :
199712
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C15-H26-O
MOLECULAR WEIGHT :
222.41
WISWESSER LINE NOTATION :
L66 BVTJ A1 F1 IY1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
350 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
IJMRAQ Indian Journal of Medical Research. (Indian Council of Medical Research, Ansari Nagar, New Delhi 110 029, India) V.1- 1913- Volume(issue)/page/year: 46,782,1958
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Mammal - species unspecified
DOSE/DURATION :
580 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
29ZRAX "Pharmacology of Oriental Plants," Chen, K.K., and B. Mukerji, Oxford, UK, Pergamon Press Ltd., 1965 Volume(issue)/page/year: -,51,1965
HS Code 2914299000
HS Code 2914299000
Summary 2914299000. other cyclanic, cyclenic or cyclotherpenic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%