Cyclohexanepropanoicacid,1-hydroxy-,gamma-lactone

Modify Date: 2025-08-25 19:28:30

Cyclohexanepropanoicacid,1-hydroxy-,gamma-lactone Structure
Cyclohexanepropanoicacid,1-hydroxy-,gamma-lactone structure
Common Name Cyclohexanepropanoicacid,1-hydroxy-,gamma-lactone
CAS Number 699-61-6 Molecular Weight 154.20600
Density 1.07g/cm3 Boiling Point 260.5ºC at 760 mmHg
Molecular Formula C9H14O2 Melting Point 26-27 °C
MSDS N/A Flash Point 102.7ºC

 Names

Name 1-Oxaspiro[4.5]decan-2-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.07g/cm3
Boiling Point 260.5ºC at 760 mmHg
Melting Point 26-27 °C
Molecular Formula C9H14O2
Molecular Weight 154.20600
Flash Point 102.7ºC
Exact Mass 154.09900
PSA 26.30000
LogP 2.02630
Index of Refraction 1.488
InChIKey QYNYVJFXPJUEMW-UHFFFAOYSA-N
SMILES O=C1CCC2(CCCCC2)O1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RP3600000
CHEMICAL NAME :
1-Oxaspiro(4,5)decan-2-one
CAS REGISTRY NUMBER :
699-61-6
BEILSTEIN REFERENCE NO. :
0119536
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H14-O2
MOLECULAR WEIGHT :
154.23
WISWESSER LINE NOTATION :
T5OVXTJ C-& AL6XTJ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
90 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 10,243,1960

 Safety Information

Hazard Codes Xi
HS Code 2932209090

 Synthetic Route

 Customs

HS Code 2932209090
Summary 2932209090. other lactones. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

4,4-pentamethylene-butanolide
1-oxaspiro[4,5]-decan-2-one
1-Oxa-spiro[4.5]decan-2-on
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