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471-01-2 73126-99-5
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471-01-2

471-01-2 structure
471-01-2 structure
  • Name: 3,5,5-trimethylcyclohex-3-en-1-one
  • Chemical Name: 3,5,5-trimethylcyclohex-3-en-1-one
  • CAS Number: 471-01-2
  • Molecular Formula: C9H14O
  • Molecular Weight: 138.20700
  • Create Date: 2018-12-05 23:15:36
  • Modify Date: 2024-01-15 01:12:48
Name 3,5,5-trimethylcyclohex-3-en-1-one
Synonyms 3,3,5-trimethyl-cyclohex-4-en-1-one
3,5,5-TRIMETHYL-3-CYCLOHEXEN-1-ONE
3,5,5-trimethylcyclohexa-3-en-1-one
3-Cyclohexen-1-one,3,5,5-trimethyl
3,5,5-trimethylcyclohexa-3-en-one
trimethyl-3,5,5 cyclohexene-3 one-1
3,5,5-Trimethyl-3-cyclohexen-1-one
EINECS 207-434-1
Density 0.905g/cm3
Boiling Point 189.2ºC at 760mmHg
Molecular Formula C9H14O
Molecular Weight 138.20700
Flash Point 64.2ºC
Exact Mass 138.10400
PSA 17.07000
LogP 2.32180
Vapour Pressure 0.578mmHg at 25°C
Index of Refraction 1.455

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GW7800000
CHEMICAL NAME :
3-Cyclohexen-1-one, 3,5,5-trimethyl-
CAS REGISTRY NUMBER :
471-01-2
LAST UPDATED :
199703
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C9-H14-O
MOLECULAR WEIGHT :
138.23

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: OTS0521606
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: OTS0521606 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
2950 mg/kg
TOXIC EFFECTS :
Brain and Coverings - recordings from specific areas of CNS Gastrointestinal - other changes Liver - other changes
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: OTS0521606
78-59-1 structure

78-59-1

~82%

471-01-2 structure

471-01-2
Literature: Constantino, Mauricio Gomes; Donate, Paulo Marcos; Frederico, Daniel; Carvalho, Tecia Vieira; Cardoso, Luiz Eduardo; Zukerman-Schpector, Julio Synthetic Communications, 2000 , vol. 30, # 18 p. 3327 - 3340
78-59-1 structure

78-59-1

~%

10276-21-8 structure

10276-21-8
471-01-2 structure

471-01-2
Literature: Hutter, R.; Mallat, T.; Baiker, A. Journal of the Chemical Society, Chemical Communications, 1995 , # 24 p. 2487 - 2488
78-59-1 structure

78-59-1
75-16-1 structure

75-16-1

~%

471-01-2 structure

471-01-2
Literature: Kharasch; Tawney Journal of the American Chemical Society, 1941 , vol. 63, p. 2308,2313 Journal of the American Chemical Society, 1945 , vol. 67, p. 128,130
78-59-1 structure

78-59-1
75-16-1 structure

75-16-1

~%

471-01-2 structure

471-01-2

3264-17-3 structure

3264-17-3
Literature: Kharasch; Tawney Journal of the American Chemical Society, 1941 , vol. 63, p. 2308,2313 Journal of the American Chemical Society, 1945 , vol. 67, p. 128,130 Full Text Show Details Kharasch et al. Journal of Organic Chemistry, 1956 , vol. 21, p. 322 Anm. 4
67-64-1 structure

67-64-1

~%

78-59-1 structure

78-59-1
471-01-2 structure

471-01-2
Literature: Wolff Justus Liebigs Annalen der Chemie, 1902 , vol. 322, p. 389 Full Text Show Details Bredt; Ruebel Justus Liebigs Annalen der Chemie, 1898 , vol. 299, p. 179 Full Text Show Details Tissier Annales de Chimie (Cachan, France), 1893 , vol. <6>29, p. 335 Full Text Show Details Kerp Justus Liebigs Annalen der Chemie, 1896 , vol. 290, p. 148 Full Text Show Details Kerp; Mueller Justus Liebigs Annalen der Chemie, 1898 , vol. 299, p. 214 Full Text Show Details Bredt; Ruebel Justus Liebigs Annalen der Chemie, 1896 , vol. 289, p. 10 Justus Liebigs Annalen der Chemie, 1898 , vol. 299, p. 166
141-79-7 structure

141-79-7
141-97-9 structure

141-97-9

~%

78-59-1 structure

78-59-1
471-01-2 structure

471-01-2
Literature: Wolff Justus Liebigs Annalen der Chemie, 1902 , vol. 322, p. 389
78-59-1 structure

78-59-1
60-29-7 structure

60-29-7
75-16-1 structure

75-16-1
7705-08-0 structure

7705-08-0

~%

Detail
Literature: Kharasch; Tawney Journal of the American Chemical Society, 1941 , vol. 63, p. 2308,2313 Journal of the American Chemical Society, 1945 , vol. 67, p. 128,130

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title: CAS No. 471-01-2 | Chemsrc address: https://www.chemsrc.com/en/baike/845669.html

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