2-METHYL-1,3-INDANDIONE

Modify Date: 2025-08-25 13:13:35

2-METHYL-1,3-INDANDIONE Structure
2-METHYL-1,3-INDANDIONE structure
Common Name 2-METHYL-1,3-INDANDIONE
CAS Number 876-83-5 Molecular Weight 160.16900
Density 1.217g/cm3 Boiling Point 300.2ºC at 760 mmHg
Molecular Formula C10H8O2 Melting Point N/A
MSDS N/A Flash Point 112.1ºC

 Names

Name 2-methylindene-1,3-dione
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.217g/cm3
Boiling Point 300.2ºC at 760 mmHg
Molecular Formula C10H8O2
Molecular Weight 160.16900
Flash Point 112.1ºC
Exact Mass 160.05200
PSA 34.14000
LogP 1.70170
Index of Refraction 1.574
InChIKey VBTBCNRVYWGDPP-UHFFFAOYSA-N
SMILES CC1C(=O)c2ccccc2C1=O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NK5977000
CHEMICAL NAME :
1,3-Indandione, 2-methyl-
CAS REGISTRY NUMBER :
876-83-5
BEILSTEIN REFERENCE NO. :
1563677
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C10-H8-O2
MOLECULAR WEIGHT :
160.18
WISWESSER LINE NOTATION :
L56 BV DV CHJ C1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 33,191,1975 ** REPRODUCTIVE DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intraperitoneal
DOSE :
25 mg/kg
SEX/DURATION :
female 9 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - post-implantation mortality (e.g. dead and/or resorbed implants per total number of implants) Reproductive - Specific Developmental Abnormalities - musculoskeletal system
REFERENCE :
ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 33,191,1975

 Safety Information

HS Code 2914399090

 Synthetic Route

 Customs

HS Code 2914399090
Summary 2914399090. other aromatic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

 Synonyms

2-methylindane-1,3-dione
1,3-Indandione,2-methyl
2-Methyl-1,3-indanedione
2-methyl-indene-1,3-dione
2-methyl-indan-1,3-dione
2-1,3-Methyl-indandion
2-Methyl-1,3-indandione
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