2-Methyl-2-propanyl (3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl}-3,5-dihydroxy-6-heptenoate

Basic Information

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CAS Number

355806-00-7

Molecular Formula

C26H36FN3O6S

Molecular Weight

537.65 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Physical State

Powder

Boiling Point

704.1°C at 760 mmHg

SMILES

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CC(C)C1=NC(=NC(=C1C=CC(CC(CC(=O)OC(C)(C)C)O)O)C2=CC=C(C=C2)F)N(C)S(=O)(=O)C

InChI

InChI=1S/C26H36FN3O6S/c1-16(2)23-21(13-12-19(31)14-20(32)15-22(33)36-26(3,4)5)24(17-8-10-18(27)11-9-17)29-25(28-23)30(6)37(7,34)35/h8-13,16,19-20,31-32H,14-15H2,1-7H3/b13-12+/t19-,20-/m1/s1

InChIKey

IJHZGLLGELSZAF-OKLSWEBGSA-N

LogP

3.658800000000002

Topological Polar Surface Area

129.92 Å²

Hydrogen Bond Donor/Acceptor

2 / 9

Complexity

865

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

AKOS015896307
SCHEMBL1025730
rel-tert-butyl(3R,5S,E)-7-(4-(4-fluorophenyl)-6-isopropyl-2-(N-methylmethylsulfonamido)pyrimidin-5-yl)-3,5-dihydroxyhept-6-enoate
BCP13063
DTXSID10467120
D70551
MFCD08460212
355806-00-7
AC-3415
Rosuvastatin tert-Butyl Ester
tert-butyl (E,3R,5S)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulfonyl)amino]-6-propan-2-ylpyrimidin-5-yl]-3,5-dihydroxyhept-6-enoate
tert-Butyl rosuvastatin
615263-60-0
A24806
D97190
CS-0144285
tert-butyl (3R,5S,6E)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulfonyl)amino]-6-(propan-2-yl)pyrimidin-5-yl]-3,5-dihydroxyhept-6-enoate
IJHZGLLGELSZAF-OKLSWEBGSA-N
AS-15047
ent-Rosuvastatin tert-Butyl Ester
(3R,5S,6E)-7-[4-(4-Fluorophenyl)-6-isopropyl-2-[(methanesulfonyl) methylamino]pyrimidin-5-yl]-3,5-dihydroxyhept-6-enoic acid tert-butyl ester
AKOS015841661
J-524818
AMY4204
SCHEMBL1025729
rel-tert-butyl (3R,5S,E)-7-(4-(4-fluorophenyl)-6-isopropyl-2-(N-methylmethylsulfonamido)pyrimidin-5-yl)-3,5-dihydroxyhept-6-enoate
(3R,5S,6E)-7-[4-(4-Fluorophenyl)-6-isopropyl-2-[(methanesulfonyl) methylamino]-pyrimidin-5-yl]-3,5-dihydroxyhept-6-enoic acid tert-butyl ester
(3R,5S,E)-tert-butyl 7-(4-(4-fluorophenyl)-6-isopropyl-2-(N-methylmethylsulfonamido)pyrimidin-5-yl)-3,5-dihydroxyhept-6-enoate
C26H36FN3O6S
(3R,5S,6E)-7-[4-(4-Fluorophenyl)-6-isopropyl-2-[(methanesulfonyl) methylamino]pyrimidin-5-yl]-3,5-dihydroxyhept-6-enoic acid tert-butyl est
tert-butyl (6E)-7-{4-(4-flurophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]pyrimidin-5-yl}(3R,5S)-3,5-dihydroxyhept-6-enoate

MDL Number

MFCD08460212

Customs Code

2935009090

FAQ

What regulatory guidelines apply to 2-Methyl-2-propanyl (3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl}-3,5-dihydroxy-6-heptenoate (CAS: 355806-00-7)?

This compound is subject to various regulatory guidelines, including GHS classification, REACH regulations, and FDA/EPA requirements. It is classified as a chemical substance that may require registration and reporting under REACH. In the USA, it is regulated by the EPA for environmental protection and may be subject to specific handling and disposal regulations. Additionally, it should comply with local and national laws regarding hazardous materials.

Are there alternatives to 2-Methyl-2-proanyl (3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl}-3,5-dihydroxy-6-heptenoate (CAS: 355806-00-7) in synthesis?

While this compound is unique, there are alternative reagents and synthetic methods that can be used. For instance, related fluoro-containing pyrimidines or isopropyl-substituted compounds can be considered. Additionally, using different functional groups or substituents can lead to similar structural analogs. These alternatives may offer better reactivity or synthetic convenience depending on the specific application.

What is the market or research trend for 2-Methyl-2-proanyl (3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl}-3,5-dihydroxy-6-heptenoate (CAS: 355806-00-7)?

The market for this compound is likely to be niche, with potential research trends focusing on its unique chemical properties. It could be explored in areas such as medicinal chemistry, organic synthesis, and pharmaceuticals. Market trends suggest increasing interest in new chemical entities with specific biological activities, which could drive demand. Research is likely to focus on its application in drug discovery and development.

How should waste containing 2-Methyl-2-proanyl (3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl}-3,5-dihydroxy-6-heptenoate (CAS: 355806-00-7) be handled?

Waste containing this compound should be handled according to local and national regulations for hazardous materials. It is recommended to collect waste in appropriate containers and ensure proper labeling. Incineration or professional waste disposal services should be used to dispose of the waste. Environmental protection precautions include minimizing the release of the compound into the environment and ensuring all safety measures are followed during handling and disposal.

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2-Methyl-2-propanyl (3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl}-3,5-dihydroxy-6-heptenoate | CAS No. 355806-00-7

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Physical State

Boiling Point

Chemical Properties

SMILES

InChI

InChIKey

LogP

Topological Polar Surface Area

Hydrogen Bond Donor/Acceptor

Complexity

Safety Information

Hazard Statement

Synonyms & References

English

MDL Number

Customs Code

FAQ

What regulatory guidelines apply to 2-Methyl-2-propanyl (3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl}-3,5-dihydroxy-6-heptenoate (CAS: 355806-00-7)?

Are there alternatives to 2-Methyl-2-proanyl (3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl}-3,5-dihydroxy-6-heptenoate (CAS: 355806-00-7) in synthesis?

What is the market or research trend for 2-Methyl-2-proanyl (3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl}-3,5-dihydroxy-6-heptenoate (CAS: 355806-00-7)?

How should waste containing 2-Methyl-2-proanyl (3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl}-3,5-dihydroxy-6-heptenoate (CAS: 355806-00-7) be handled?

Related Compounds

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