ACETIC ACID-4,6-DINITRO-o-CRESYL ESTER

Modify Date: 2025-09-10 19:47:20

ACETIC ACID-4,6-DINITRO-o-CRESYL ESTER Structure
ACETIC ACID-4,6-DINITRO-o-CRESYL ESTER structure
 Common Name ACETIC ACID-4,6-DINITRO-o-CRESYL ESTER
CAS Number 18461-55-7 Molecular Weight 240.17000
Density 1.437g/cm3 Boiling Point 382.9ºC at 760 mmHg
Molecular Formula C9H8N2O6 Melting Point N/A
MSDS N/A Flash Point 182ºC

 Names

Name (2-methyl-4,6-dinitrophenyl) acetate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.437g/cm3
Boiling Point 382.9ºC at 760 mmHg
Molecular Formula C9H8N2O6
Molecular Weight 240.17000
Flash Point 182ºC
Exact Mass 240.03800
PSA 117.94000
LogP 2.78310
Vapour Pressure 4.57E-06mmHg at 25°C
Index of Refraction 1.579
InChIKey OEMKFZGDLXBFNO-UHFFFAOYSA-N
SMILES CC(=O)Oc1c(C)cc([N+](=O)[O-])cc1[N+](=O)[O-]

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GP0175000
CHEMICAL NAME :
o-Cresol, 4,6-dinitro-, acetate
CAS REGISTRY NUMBER :
18461-55-7
BEILSTEIN REFERENCE NO. :
1994636
LAST UPDATED :
199612
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C9-H8-N2-O6
MOLECULAR WEIGHT :
240.19
WISWESSER LINE NOTATION :
WNR C1 ENW BOV1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,749,1986
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,749,1986 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
62500 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 6,146,1954

 Safety Information

HS Code 2915390090

 Synthetic Route

Dinitro-ortho-cresol structure

Dinitro-ortho-cresol

CAS#:534-52-1

Ethanoic anhydride structure

Ethanoic anhydride

CAS#:108-24-7

~70%

ACETIC ACID-4,6-DINITRO-o-CRESYL ESTER Structure

ACETIC ACID-4,6...

CAS#:18461-55-7

Literature: Marsh, Mary Rose; Gold, Victor; Hall, C. Dennis; Sghibartz, Christopher Journal of Chemical Research, Miniprint, 1989 , # 8 p. 1801 - 1814
o-cresol structure

o-cresol

CAS#:95-48-7

~%

ACETIC ACID-4,6-DINITRO-o-CRESYL ESTER Structure

ACETIC ACID-4,6...

CAS#:18461-55-7

Literature: Gibson Journal of the Chemical Society, 1925 , vol. 127, p. 45

 Customs

HS Code 2915390090
Summary 2915390090. esters of acetic acid. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:5.5%. General tariff:30.0%

 Synonyms

Acetic acid,4,6-dinitro-o-cresyl ester
Phenol,2-methyl-4,6-dinitro,acetate
3.5-Dinitro-2-acetoxy-toluol
2-methyl-4,6-dinitrophenyl acetate
3.5-Dinitro-2-acetoxy-1-methyl-benzol
o-CRESOL,4,6-DINITRO-,ACETATE
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