(2H12)シクロヘキサン

Cyclohexane-D12

HCID 123129CAS 1735-17-7
部分構造検索類似構造を探す

基本情報

標準SMILES
[2H]C1([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C1([2H])[2H]
InChIKey
XDTMQSROBMDMFD-LBTWDOQPSA-N
分子式
C6H12
平均分子量
96.23 g/mol
単同位体質量
96.16922134

名称と識別子

優先名称
Cyclohexane-D12
IUPAC
1,1,2,2,3,3,4,4,5,5,6,6-dodecadeuteriocyclohexane
現地名
(2H12)シクロヘキサン
英語名
Cyclohexane-d12
分子式
C6D12
分子量
96.23

名称と別名

Cyclohexane-d12(2H12)Cyclohexane[2H12]cyclohexaneEINECS 217-077-3DTXSID80169624UN1145Deuterated cyclohexaneRefChem:129546DTXCID5092115217-077-3XDTMQSROBMDMFD-LBTWDOQPSA-N1735-17-7
名称をさらに表示
ペルジュウテロシクロヘキサン(2H12)シクロヘキサンシクロヘキサン(D12)シクロヘキサン-D12(重水素化率99.5%)シクロヘキサン‐D12(重水素化率99.5%)シクロヘキサン-D12シクロヘキサン-D12, 99.6%シクロヘキサン- D12 , 99.7% D ATOM.CycohexaneCyclohexaneD12>99.7%PerdeuterocyclohexaneCyclohexane-d12 NO.DODECADEUTEROCYCLOHEXANEBROMOBENZENE-500G(99.5%)CYCLOHEXANE-D12,99.7ATOM%DCYCLOHEXANE-D12 (D, 99.5%)
Cyclohexane D12 >99.5%CYCLOHEXANE-1,1,2,2,3,3,4,4,5,5,6,6-D121,1,2,2,3,3,4,4,5,5,6,6-dodecadeuteriocyclohexaneMFCD00044212Cyclohexane, d12Cyclohexane-d12 (reagent grade)Cyclohexane-d12, >=99.6 atom % DCyclohexane #

データベース識別子

CAS
1735-17-7
PubChem CID
123129
DTXSID
DTXSID80169624
EC Number
217-077-3
Nikkaji
J95.386E

物性

構造計算による物性

XLogP
3.4
極性表面積
0 Ų
水素結合供与体数
0
水素結合受容体数
0
回転可能結合数
0
重原子数
6

実験および物理化学的性質

SolventsSolvents -> Aliphatics, Saturated (<C12)
Physical DescriptionLiquid; [Alfa Aesar MSDS]

物理化学的性質

融点
6.5 °C · 6.5°C
沸点
80 · 80,7°C
比重(密度)
0.893 g/mL · 0.893 g/mL at 25 °C(lit.)
屈折率
20 · n20/D 1.421(lit.)
闪点
1 °F · −1 °F
貯蔵温度
Flammables area

化学的性質

化学的特性colourless liquid with mild odour

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P271, P273, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P319, P321, P331, P332+P317, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory InformationCyclohexane-D12: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazards SummaryAn irritant; High vapor concentrations can cause narcotic effects; Harmful by ingestion (may cause lung damage by aspiration); [Alfa Aesar MSDS] See Cyclohexane. See Deuterium.
Hazard Classes and CategoriesFlam. Liq. 2 (100%)

毒性情報

Adverse EffectsNeurotoxin - Acute solvent syndrome

安全データ

F
9
wgk
3
ridadr
UN 1145 3/PG 2
hs_code
29021100
risk_code
11-38-50/53-65-67
安衛法
57,57-2

化学と産業

応用分野 · 2 件

使用It is a commonsolventused inNMR spectroscopy.

一般的な説明Cyclohexane-d12, a deuterated cyclohexane, is a standard purity solvent useful for routine NMR (Nuclear Magnetic Resonance) studies. Its infrared (vapor and liquid phase in the range of 376-4000cm-1) and Raman (liquid phase) spectral investigations have been reported. Ring inversion of cyclohexane-d12 has been studied by recording its deuterium NMR spectrum in the temperature range -36 to +115°C. It can be prepared by reacting benzene-d6 and deuterium.

上流・下流製品情報

サプライヤー50 社

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
盐城通铭生物科技有限公司15195160625 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
武汉鹏垒生物科技有限公司15871464247 · [email protected]
湖北云镁科技有限公司027-59206672 18995657604 · [email protected]

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