2,4,6-Cycloheptatrien-1-one,3-iodo-2-[(4-nitrobenzoyl)oxy]-

Modify Date: 2024-01-29 20:02:46

2,4,6-Cycloheptatrien-1-one,3-iodo-2-[(4-nitrobenzoyl)oxy]- Structure
2,4,6-Cycloheptatrien-1-one,3-iodo-2-[(4-nitrobenzoyl)oxy]- structure
Common Name 2,4,6-Cycloheptatrien-1-one,3-iodo-2-[(4-nitrobenzoyl)oxy]-
CAS Number 2961-87-7 Molecular Weight 397.12100
Density 1.85g/cm3 Boiling Point 490ºC at 760mmHg
Molecular Formula C14H8INO5 Melting Point N/A
MSDS N/A Flash Point 250.2ºC

 Names

Name (2-iodo-7-oxocyclohepta-1,3,5-trien-1-yl) 4-nitrobenzoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.85g/cm3
Boiling Point 490ºC at 760mmHg
Molecular Formula C14H8INO5
Molecular Weight 397.12100
Flash Point 250.2ºC
Exact Mass 396.94500
PSA 89.19000
LogP 3.30200
Vapour Pressure 9.47E-10mmHg at 25°C
Index of Refraction 1.691

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GU4100000
CHEMICAL NAME :
2,4,6-Cycloheptatrien-1-one, 2-hydroxy-3-iodo-, p-nitrobenzoate
CAS REGISTRY NUMBER :
2961-87-7
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C14-H8-I-N-O5
MOLECULAR WEIGHT :
397.13
WISWESSER LINE NOTATION :
L7VJ BOVR DNW& CI

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#03802

 Safety Information

HS Code 2916399090

 Customs

HS Code 2916399090
Summary 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

2,4,6-CYCLOHEPTATRIEN-1-ONE,2-HYDROXY-3-IODO-,p-NITROBENZOATE
WLN: L7VJ BOVR DNW&2-Hydroxy-3-iodo-2,4,6-cycloheptatrien-1-one p-nitrobenzoate