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Merck

392898

Sigma-Aldrich

2-丙醇-1,1,1,3,3,3-d6

99 atom % D

别名:

异丙基-1,1,1,3,3,3-d6 醇, 异丙醇-1,1,1,3,3,3-d6

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About This Item

线性分子式:
(CD3)2CHOH
CAS号:
分子量:
66.13
Beilstein:
1699397
MDL號碼:
分類程式碼代碼:
12142201
PubChem物質ID:
NACRES:
NA.21

同位素純度

99 atom % D

品質等級

化驗

99% (CP)

形狀

liquid

技術

NMR: suitable

折射率

n20/D 1.374 (lit.)

bp

82 °C (lit.)

mp

-90 °C (lit.)

密度

0.86 g/mL at 25 °C

質量偏移

M+6

SMILES 字串

[2H]C([2H])([2H])C(O)C([2H])([2H])[2H]

InChI

1S/C3H8O/c1-3(2)4/h3-4H,1-2H3/i1D3,2D3

InChI 密鑰

KFZMGEQAYNKOFK-WFGJKAKNSA-N

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一般說明

2-Propanol-1,1,1,3,3,3-d6 is 2-propanol with the hydrogen atoms on the –CH3 groups replaced by deuterium. It has been reported to be synthesized by the reduction of per-deuterioacetone. Studies show that it exists in anti and gauche conformation.

應用

2-Propanol-1,1,1,3,3,3-d6 may be used in the synthesis of isotopomers of isopropylformate.

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象形圖

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訊號詞

Danger

危險聲明

危險分類

Eye Irrit. 2 - Flam. Liq. 2 - STOT SE 3

標靶器官

Central nervous system

儲存類別代碼

3 - Flammable liquids

水污染物質分類(WGK)

WGK 1

閃點(°F)

60.8 °F - closed cup

閃點(°C)

16 °C - closed cup


历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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其他客户在看

Slide 1 of 1

1 of 1

Mass spectrometry in structural and stereochemical problems. CLXXXVIII. Electron impact induced behavior of branched ketones and esters, with special emphasis on hydrogen rearrangements.
Eadon G and Djerassi C.
Journal of the American Chemical Society, 92(10), 3084-3089 (1970)
Vibrational and rotational spectra, conformations and ab initio calculations of thiocyanatoethene.
Beukes JA, et al.
Journal of Raman Spectroscopy, 26(8-9), 799-812 (1995)
Conformational analysis and vibrational spectra of isopropyl formate and some deuterated isotopomers.
Rosas RL, et al.
Journal of Raman Spectroscopy, 24(3), 143-165 (1993)

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