Butanoic acid, 2-cyano-, 1,1-dimethylethyl ester, also known as tert-butyl 2-cyanobutanoate, is a chemical compound with the molecular formula C8H13NO2. It is an ester derived from butanoic acid and 1,1-dimethylethyl alcohol (tert-butanol). This colorless liquid is used as a synthetic intermediate in the production of various pharmaceuticals, agrochemicals, and other organic compounds. The compound is characterized by its ester functional group, which is formed by the reaction of the carboxylic acid group of butanoic acid with the hydroxyl group of tert-butanol. The presence of the cyano group (-CN) in the molecule provides it with unique reactivity and properties, making it a valuable building block in organic synthesis.
1114-82-5
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Basic information
- Product Name: Butanoic acid, 2-cyano-, 1,1-dimethylethyl ester
- Synonyms:
- CAS NO:1114-82-5
- Molecular Formula: C9H15NO2
- Molecular Weight: 169.224
- EINECS: N/A
- Product Categories: N/A
- Mol File: 1114-82-5.mol
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Chemical Properties
- Melting Point: N/A
- Boiling Point: N/A
- Flash Point: N/A
- Appearance: N/A
- Density: N/A
- Refractive Index: N/A
- Storage Temp.: N/A
- Solubility: N/A
- CAS DataBase Reference: Butanoic acid, 2-cyano-, 1,1-dimethylethyl ester(CAS DataBase Reference)
- NIST Chemistry Reference: Butanoic acid, 2-cyano-, 1,1-dimethylethyl ester(1114-82-5)
- EPA Substance Registry System: Butanoic acid, 2-cyano-, 1,1-dimethylethyl ester(1114-82-5)
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Safety Data
- Hazard Codes: N/A
- Statements: N/A
- Safety Statements: N/A
- WGK Germany:
- RTECS:
- HazardClass: N/A
- PackingGroup: N/A
- Hazardous Substances Data: 1114-82-5(Hazardous Substances Data)
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1114-82-5 Usage
Check Digit Verification of cas no
The CAS Registry Mumber 1114-82-5 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 1,1,1 and 4 respectively; the second part has 2 digits, 8 and 2 respectively.Calculate Digit Verification of CAS Registry Number 1114-82:
(6*1)+(5*1)+(4*1)+(3*4)+(2*8)+(1*2)=45
45 % 10 = 5
So 1114-82-5 is a valid CAS Registry Number.
1114-82-5Upstream product
1114-82-5Downstream Products
- 1455088-14-8 2-{[(1-cyano-4-hydroxy-7-phenoxyisoquinoline-3-carbonyl)amino]-methyl}-2-methylbutyric acid
- 1455092-99-5 2-{[(1-cyano-4-hydroxy-7-phenoxyisoquinoline-3-carbonyl)amino]methyl}-2-methylbutyric acid tert-butyl ester
- 1304683-85-9 (2S,3S)-tert-butyl 2-cyano-2-ethyl-3-(4-nitrophenyl)pent-4-enoate
- 1304683-83-7 (2S,3S)-tert-butyl 3-(4-methoxyphenyl)-2-cyano-2-ethylpent-4-enoate
- 1304683-82-6 (2S,3S)-tert-butyl3-(4-fluorophenyl)-2-cyano-2-ethylpent-4-enoate
- 1304683-75-7 (2S,3S)-tert-butyl 2-cyano-2-ethyl-3-phenylpent-4-enoate
- 1304683-86-0 (2S,3S)-tert-butyl 3-(3,5-dibromophenyl)-2-cyano-2-ethylpent-4-enoate
- 1304683-84-8 (2S,3S)-tert-butyl 3-(4-bromophenyl)-2-cyano-2-ethylpent-4-enoate
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Butanoic acid, 2-cyano-, 1,1-dimethylethyl ester
