(1S,4aS,8aS)-1-Hydroxymethyl-1,4,4a,5,8,8a-hexahydro-isochromen-3-one is a complex organic compound with a molecular formula of C10H12O3. It is a hexahydro-isochromenone derivative, which is a type of heterocyclic compound containing a six-membered ring with two oxygen atoms. This specific compound features a hydroxymethyl group (-CH2OH) at the 1-position, and the stereochemistry is defined by the (1S,4aS,8aS) configuration, indicating the spatial arrangement of the atoms at these positions. It is an important intermediate in the synthesis of various pharmaceuticals and natural products due to its unique structure and reactivity. The compound is known for its potential applications in the development of drugs targeting various therapeutic areas, such as anti-inflammatory and anticancer agents, owing to its ability to interact with biological targets.
96422-85-4
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Basic information
- Product Name: (1S,4aS,8aS)-1-Hydroxymethyl-1,4,4a,5,8,8a-hexahydro-isochromen-3-one
- Synonyms: (1S,4aS,8aS)-1-Hydroxymethyl-1,4,4a,5,8,8a-hexahydro-isochromen-3-one
- CAS NO:96422-85-4
- Molecular Formula:
- Molecular Weight: 182.219
- EINECS: N/A
- Product Categories: N/A
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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: (1S,4aS,8aS)-1-Hydroxymethyl-1,4,4a,5,8,8a-hexahydro-isochromen-3-one(CAS DataBase Reference)
- NIST Chemistry Reference: (1S,4aS,8aS)-1-Hydroxymethyl-1,4,4a,5,8,8a-hexahydro-isochromen-3-one(96422-85-4)
- EPA Substance Registry System: (1S,4aS,8aS)-1-Hydroxymethyl-1,4,4a,5,8,8a-hexahydro-isochromen-3-one(96422-85-4)
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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: 96422-85-4(Hazardous Substances Data)
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Check Digit Verification of cas no
The CAS Registry Mumber 96422-85-4 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 9,6,4,2 and 2 respectively; the second part has 2 digits, 8 and 5 respectively.Calculate Digit Verification of CAS Registry Number 96422-85:
(7*9)+(6*6)+(5*4)+(4*2)+(3*2)+(2*8)+(1*5)=154
154 % 10 = 4
So 96422-85-4 is a valid CAS Registry Number.
96422-85-4Upstream product
96422-85-4Downstream Products
- 96422-86-5 2-[(1S,6S)-6-((S)-1,2-Dihydroxy-ethyl)-cyclohex-3-enyl]-N-[2-(1H-indol-3-yl)-ethyl]-acetamide
- 483-26-1 (-)-alloyohimbane
- 96422-88-7 (1S,2S)-N-<2-(1H-Indol-3-yl)ethyl>-1-(hydroxymethyl)cyclohex-4-ene-2-acetamide
- 96422-89-8 2-((1S,6S)-6-Chloromethyl-cyclohex-3-enyl)-N-[2-(1H-indol-3-yl)-ethyl]-acetamide
- 96422-87-6 2-((1S,6S)-6-Formyl-cyclohex-3-enyl)-N-[2-(1H-indol-3-yl)-ethyl]-acetamide
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(1S,4aS,8aS)-1-Hydroxymethyl-1,4,4a,5,8,8a-hexahydro-isochromen-3-one
