化学百科 / Organic Intermediate / Pharmaceutical Intermediates / Organic Intermediates

(R)-(+)-2,2-ジメチル-1,3-ジオキソラン-4-カルボキシアルデヒド

CAS：15186-48-8
MW:130.143
MF：C6H10O3

(R)-(+)-2,2-Dimethyl-1,3-dioxolane-4-carboxaldehyde, with the chemical formula C7H12O3 and CAS registry number 15186-48-8, is a compound known for its applications in various chemical processes. This colorless liquid, also referred to as (R)-(+)-Dimethyl-1,3-dioxolane-4-carboxaldehyde, is characterized by its dioxolane and carboxaldehyde functional groups. It is commonly used as a chiral building block in organic synthesis, offering a versatile platform for the introduction of the (R)-(+)-dimethyl-1,3-dioxolane-4-carboxaldehyde moiety into different molecules.

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名前と識別子
性質
安全文
MSDS情報
その他の情報
計算化学データ
関連する問題
実際の製品情報

1. 名前と識別子

1.1 商品名: (R)-(+)-2,2-ジメチル-1,3-ジオキソラン-4-カルボキシアルデヒド

1.2 同義語: (R)-2,2-DIMETHYL-[1,3]DIOXOLANE-4-CARBALDEHYDE;(R)-(+)-2,2-DIMETHYL-1,3-DIOXOLANE-4-CARBOXALDEHYDE;(R)-2,3-ISOPROPYLIDENE GLYCERALDEHYDE;1,3-DIOXOLANE-4-CARBOXALDEHYDE, 2,2-DIMETHYL-, (R)-;2,3-O-ISOPROPYLIDENE-D-GLYCERALDEHYDE;2,3-O-(R)-ISOPROPYLIDENE-L-GLYCERALDEHYDE;(4R)-2,2-DIMETHYL-1,3-DIOXOLANE-4-CARBALDEHYDE;D-(R)-GLYCERALDEHYDE ACETONIDE;（R）-（+）-2,2-ジメチル-1,3-ジオキソラン-4-カルボキサルデヒド

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1.3 CAS No.: 15186-48-8

1.4 CID: 259712

1.5 EINECS番号: 227-244-2

1.6 分子式: C6H10O3

1.7 Inchi: InChI=1S/C6H10O3/c1-6(2)8-4-5(3-7)9-6/h3,5H,4H2,1-2H3/t5-/m0/s1

1.8 InchiKey: YSGPYVWACGYQDJ-YFKPBYRVSA-N

1.9 標準的な SMILES: CC1(OCC(O1)C=O)C

1.10 異性体 SMILES: CC1(OC[C@@H](O1)C=O)C

2. 性質

2.1 沸点: 139°C（点灯）

2.2 可溶性: Difficult to mix.

2.3 Storage: ？20°C

3. 安全文

3.1 WGKドイツ: 3

3.2 安全と危険

WGKドイツ	3
ストレージクラス	6.1

4. MSDS情報

2.Hazard identification

2.1 Classification of the substance or mixture

Skin irritation, Category 2

Eye irritation, Category 2

Specific target organ toxicity \u2013 single exposure, Category 3

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word	Warning
Hazard statement(s)	H315 Causes skin irritation H319 Causes serious eye irritation H335 May cause respiratory irritation
Precautionary statement(s)
Prevention	P264 Wash ... thoroughly after handling. P280 Wear protective gloves/protective clothing/eye protection/face protection. P261 Avoid breathing dust/fume/gas/mist/vapours/spray. P271 Use only outdoors or in a well-ventilated area.
Response	P302+P352 IF ON SKIN: Wash with plenty of water/... P321 Specific treatment (see ... on this label). P332+P313 If skin irritation occurs: Get medical advice/attention. P362+P364 Take off contaminated clothing and wash it before reuse. P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. P337+P313 If eye irritation persists: Get medical advice/attention. P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing. P312 Call a POISON CENTER/doctor/\u2026if you feel unwell.
Storage	P403+P233 Store in a well-ventilated place. Keep container tightly closed. P405 Store locked up.
Disposal	P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

すべてを表示

5. 合成路線

15186-48-8Total: 24 合成路線

1707-77-3 173 しいれ業者

15186-48-8 159 しいれ業者

3969-61-7 9 しいれ業者

15186-48-8 159 しいれ業者

すべてを表示

6. 前駆体と製品

上位製品:

4306-35-8

70223-09-5

3427-24-5

3969-61-7

1707-77-3

64870-23-1

22323-82-6

22323-78-0

53735-98-1

下流製品:

85820-82-2

52373-72-5

90472-93-8

23788-74-1

453-17-8

51268-87-2

82954-65-2

22323-82-6

79060-23-4

18524-18-0

7. 計算化学データ

Molecular Weight：130.143g/mol
Molecular Formula：C₆H₁₀O₃
Compound Is Canonicalized：True
Exact Mass：0
XLogP3-AA：130.062994177
Monoisotopic Mass：130.062994177
Complexity：120
Rotatable Bond Count：1
Hydrogen Bond Donor Count：0
Hydrogen Bond Acceptor Count：3
Topological Polar Surface Area：35.5
Heavy Atom Count：：9
Defined Atom Stereocenter Count：1
Undefined Atom Stereocenter Count：0
Defined Bond Stereocenter Count：0
Undefined Bond Stereocenter Count：0
Isotope Atom Count：0
Covalently-Bonded Unit Count：1
CACTVS Substructure Key Fingerprint：AAADccBgMAAAAAAAAAAAAAAAAAAAASAAAAAAAAAAAAAAAAAAAAAAGgAAAAAACBSggAICCAAABAAIAAgQgAIAAAAAAAAAAAFAAAARAAQAAAQiAAAAIAAGAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

8.その他の情報

NIST化学のリファレンス: アセトンD-グリセルアルデヒド（15186-48-8）

9. Toltal 145 しいれ業者詳細を表示

(R)-(+)-2,2-Dimethyl-1,3-dioxolane-4-carboxaldehyde CAS 15186-48-8

Wuhan Fortuna Chemical Co., Ltd.

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Tel: Update Time:2024/08/08

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(R)-(+)-2,2-Dimethyl-1,3-dioxolane-4-carboxaldehyde

CANGZHOU ENKE PHARMA-TECH CO.,LTD

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Tel: Update Time:2024/11/12

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Factory Supply 2,3-O-isopropylidene- D-glyceraldehyde

Amitychem Corporation

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Tel: Update Time:2023/06/28

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Dayang Chem (Hangzhou) Co., Ltd.

^1YR

Tel: Update Time:2024/06/17

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1,3-Dioxolane-4-carboxaldehyde,2,2-dimethyl-, (4R)-

Jinlan Pharm-Drugs Technology Co., Limited

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Tel: Update Time:2024/08/08

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10. 関連する問題

: What is the application of (R)-(+)-2,2-Dimethyl-1,3-dioxolane-4-carboxaldehyde?(R)-(+)-2,2-Dimethyl-1,3-dioxolane-4-carboxaldehyde, also known as (R)-(+)-2,2-Dimethyl-1,3-dioxolane-4-carboxaldehyde, is a colorless to pale yellow liquid at room temperature and pressure. It is a c..; How to Prepare (R)-(+)-2,2-Dimethyl-1,3-dioxolane-4-carboxaldehyde?Background and Overview[1] (R)-(+)-2,2-Dimethyl-1,3-dioxolane-4-carboxaldehyde, also known as R-glyceraldehyde propylene ketal, is an intermediate in the synthesis of gemcitabine. Gemcitabine hydrochl..

11. 実際の製品情報