ChemicalBook > CAS DataBase List > (S)-(-)-3-CYCLOHEXENECARBOXYLIC ACID
(S)-(-)-3-CYCLOHEXENECARBOXYLIC ACID
- Product Name
- (S)-(-)-3-CYCLOHEXENECARBOXYLIC ACID
- CAS No.
- 5708-19-0
- Chemical Name
- (S)-(-)-3-CYCLOHEXENECARBOXYLIC ACID
- Synonyms
- (S)-cyclohex-3-ene-1-carboxylic acid;(S)-Cyclohex-3-enecarboxylic acid;(S)-3-Cyclohexene-1-carboxylic Acid;(1S)-cyclohex-3-ene-1-carboxylic acid;(S)-(-)-3-CYCLOHEXENEC;(S)-(-)-3-CYCLOHEXENECARBOXYLICA;(1S)-3-cyclohexenecarboxylic acid;(S)-(-)-3-Cyclohexenecaboxylic acid;(S)-(-)-3-cyclohexencarboxylic acid;(1S)-cyclohex-3-ene-1-carboxylicaci
- CBNumber
- CB7374252
- Molecular Formula
- C7H10O2
- Formula Weight
- 126.15
- MOL File
- 5708-19-0.mol
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(S)-(-)-3-CYCLOHEXENECARBOXYLIC ACID Property
- Melting point:
- 19°C(lit.)
- Boiling point:
- 118°C/6mmHg(lit.)
- Density
- 1.126±0.06 g/cm3(Predicted)
- refractive index
- 1.4780 to 1.4820
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- form
- clear liquid
- pka
- 4.67±0.20(Predicted)
- color
- Colorless to Almost colorless
- InChI
- InChI=1S/C7H10O2/c8-7(9)6-4-2-1-3-5-6/h1-2,6H,3-5H2,(H,8,9)/t6-/m1/s1
- InChIKey
- VUSWCWPCANWBFG-ZCFIWIBFSA-N
- SMILES
- [C@H]1(C(O)=O)CCC=CC1
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Safety
- Hazard Codes
- C
- Risk Statements
- 34
- Safety Statements
- 26-36/37/39-45
- RIDADR
- UN 3265 8 / PGIII
- HazardClass
- 8
- PackingGroup
- III
- HS Code
- 2916200090
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Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Danger
- Hazard statements
-
H314Causes severe skin burns and eye damage
- Precautionary statements
-
P280Wear protective gloves/protective clothing/eye protection/face protection.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P310Immediately call a POISON CENTER or doctor/physician.
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N-Bromosuccinimide Price
TCI Chemical
- Product number
- C3236
- Product name
- (S)-(-)-3-Cyclohexene-1-carboxylic Acid
- Purity
- >98.0%(GC)(T)
- Packaging
- 1g
- Price
- $81
- Updated
- 2025/07/31
TRC
- Product number
- C988285
- Product name
- (S)-(-)-3-Cyclohexene-1-carboxylic Acid
- Packaging
- 500mg
- Price
- $160
- Updated
- 2021/12/16
TRC
- Product number
- C988285
- Product name
- (S)-(-)-3-Cyclohexene-1-carboxylic Acid
- Packaging
- 5g
- Price
- $1260
- Updated
- 2021/12/16
Biosynth Carbosynth
- Product number
- FC137309
- Product name
- (S)-(-)-3-Cyclohexene-1-carboxylic acid
- Packaging
- 10g
- Price
- $130
- Updated
- 2021/12/16
AK Scientific
- Product number
- 9066AH
- Product name
- (S)-(-)-3-Cyclohexenecarboxylicacid
- Packaging
- 5g
- Price
- $27
- Updated
- 2021/12/16
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(S)-(-)-3-CYCLOHEXENECARBOXYLIC ACID Chemical Properties,Usage,Production
Uses
(S)-(-)-3-CYCLOHEXENECARBOXYLIC ACID can be used as organic synthesis intermediates and pharmaceutical intermediates, mainly used in laboratory research and development processes and chemical production processes.
Uses
(S)-3-Cyclohexene-1-carboxylic Acid has been used as a reactant for the preparation of N-[(1R,2S,5S)-2-{[(5-chloroindol-2-yl)carbonyl]amino}-5-(dimethylcarbamoyl)cyclohexyl]-5-methyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxamide hydrochloride, a potent and orally active direct inhibitor of factor Xa.
Synthesis
54.94 g of cyclohex-3-ene-1(S)-carboxylic acid (R)-(+)-methylbenzylamine salt and 18.2 volumes of H2O were charged to a flask at 20-25°C and stirred. To the mixture obtained further 6.7 volumes of H2O and 10 volumes of EtOAc were added. The mixture obtained was stirred for 15 min, the phases were separated and the organic layer was discarded. The aqueous layer was treated with 10 volumes of MTBE and 2.5 equivalents of 6M HCI were added slowly. The mixture obtained was stirred and two layers were formed, separated and the aqueous layer was extracted with MTBE. The organic layers obtained were combined and washed with aqueous, 30percent NaCl solution. The organic phase obtained was dried over Na2S04, filtered, and from the filtrate obtained solvent was removed in vacuo. Cyclohex-3-ene-1(S)-carboxylic acid in the form of a clear oil was obtained. Yield: 26.13 g (93.3percent of theory).
References
[1] Bioorganic and Medicinal Chemistry, 2009, vol. 17, # 3, p. 1193 - 1206
[2] Patent: EP2390245, 2011, A1. Location in patent: Page/Page column 15
[3] Patent: EP2399904, 2011, A1. Location in patent: Page/Page column 25
[4] Patent: EP1577301, 2005, A1. Location in patent: Page/Page column 191
[5] Patent: EP1405852, 2004, A1. Location in patent: Page 175
(S)-(-)-3-CYCLOHEXENECARBOXYLIC ACID Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from (S)-(-)-3-CYCLOHEXENECARBOXYLIC ACID manufacturers
Henan Aochuang Chemical Co.,Ltd.
- Product
- (S)-(-)-3-Cyclohexenecarboxylic acid 5708-19-0
- Price
- US $0.00-0.00/kg
- Min. Order
- 1kg
- Purity
- 98%
- Supply Ability
- 1Ton
- Release date
- 2022-09-28
Zhengzhou Anbu Chem Co.,Ltd
- Product
- (S)-(-)-3-CYCLOHEXENECARBOXYLIC ACID 5708-19-0
- Price
- US $1.00/KG
- Min. Order
- 1KG
- Purity
- 98%
- Supply Ability
- 1000KGS
- Release date
- 2023-04-24
Zhengzhou Anbu Chem Co.,Ltd
- Product
- (S)-(-)-3-CYCLOHEXENECARBOXYLIC ACID 5708-19-0
- Price
- US $0.00/KG
- Min. Order
- 0.1KG
- Purity
- 99%
- Supply Ability
- 1000KGS
- Release date
- 2023-06-13