THIOCYANATOACETIC ACID CYCLOHEXYL ESTER

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Names

[ CAS No. ]:
5349-27-9

[ Name ]:
THIOCYANATOACETIC ACID CYCLOHEXYL ESTER

[Synonym ]:
ACETIC ACID,THIOCYANATO-,CYCLOHEXYL ESTER
Cyklohexylester kyseliny thiokyanooctove
Thiocyanatoacetoxy-cyclohexan
Thiocyanato-essigsaeure-cyclohexylester
Cyklohexylthiokyanoacetat
thiocyanato-acetic acid cyclohexyl ester
Thiocyanatoacetate cyclohexyl ester

Chemical & Physical Properties

[ Density]:
1.16g/cm3

[ Boiling Point ]:
314.1ºC at 760 mmHg

[ Molecular Formula ]:
C9H13NO2S

[ Molecular Weight ]:
199.27000

[ Flash Point ]:
143.8ºC

[ Exact Mass ]:
199.06700

[ PSA ]:
75.39000

[ LogP ]:
2.07658

[ Index of Refraction ]:
1.514

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AJ6125000
CHEMICAL NAME :
Acetic acid, thiocyanato-, cyclohexyl ester
CAS REGISTRY NUMBER :
5349-27-9
BEILSTEIN REFERENCE NO. :
3259501
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H13-N-O2-S
MOLECULAR WEIGHT :
199.29
WISWESSER LINE NOTATION :
L6TJ AOV1SCN

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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: -,1040,1986

Safety Information

[ HS Code ]:
2930909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Acetic acid, 2-chloro-, cyclohexyl ester
  • Potassium thiocyanate

DownStream

Customs

[ HS Code ]: 2930909090

[ Summary ]:
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Related Compounds

  • Butanoic acid,cyclohexyl ester
  • fluorocarbonic acid cyclohexyl ester
  • Nonanoic acid,cyclohexyl ester
  • Propanoic acid,cyclohexyl ester
  • phosphoric acid cyclohexyl ester-(4-nitro-phenyl ester)
  • phosphoric acid cyclohexyl ester-(2-hydroxy-phenyl ester)
  • 1-tert-butyl 3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl) 4,4-difluoropiperidine-1,3-dicarboxylate
  • tert-butyl 2-{2-[(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)oxy]-2-oxoethyl}-1,2,3,4-tetrahydroquinoline-1-carboxylate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl (3R,4S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylhexanoate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 4-(1-{[(tert-butoxy)carbonyl]amino}ethyl)benzoate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 4-fluoro-3-(piperidine-1-sulfonyl)benzoate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 2-[({12-oxo-7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-10-yl}methyl)sulfanyl]acetate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 2-methyl-5-(piperidine-1-sulfonyl)benzoate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 4-{[(2,5-dichlorophenyl)sulfanyl]methyl}benzoate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 1-(4-chlorobenzenesulfonyl)piperidine-4-carboxylate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 4-methyl-3-(piperidine-1-sulfonyl)benzoate
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