基本情報
- 標準SMILES
CO[N+](=O)[O-]- InChIKey
LRMHVVPPGGOAJQ-UHFFFAOYSA-N- 分子式
- C.H3.N.O3
- 平均分子量
- 77.04 g/mol
- 単同位体質量
- 77.01129296
概要
C-H3-N-O3
名称と識別子
- 優先名称
- Methyl nitrate
- IUPAC
- methyl nitrate
- 現地名
- ニトロオキシメタン
- 英語名
- methyl nitrate
- 分子式
- CH3NO3
- 分子量
- 77.04
名称と別名
METHYL NITRATEnitric acid methyl ester598-58-3Nitric acid, methyl esterMethylester kyseliny dusicneLAD9RT85ESDTXSID4073205RefChem:157962DTXCID4042705209-941-3Methyl nitrate [Forbidden]EINECS 209-941-3
名称をさらに表示
メチルニトラートニトロオキシメタン硝酸メチルメチル ニトラートNitrooxymethaneNitric acid methylNitric acid, Methylester (8CI,9CI)
Methylester kyseliny dusicne [Czech]UNII-LAD9RT85ESBRN 1699872CH3ONO2METHYL NITRATE [MI]SCHEMBL268384-01-00-01254 (Beilstein Handbook Reference)SCHEMBL4246311
データベース識別子
- CAS
598-58-3- PubChem CID
- 11724
- DTXSID
DTXSID4073205- UNII
- LAD9RT85ES
- EC Number
- 209-941-3
- Nikkaji
- J2.721I
物性
構造計算による物性
- XLogP
- 0.5
- 極性表面積
- 55.1 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 3
- 回転可能結合数
- 0
- 重原子数
- 5
- 形式電荷
- 0
- 複雑度
- 36.6
実験および物理化学的性質
Chemical ClassesNitrogen Compounds -> Nitrates and Nitrites
SpringerMaterials PropertiesSchoenflies notation
Density1.208 @ 20°C
Melting Point-83 °C
Vapor Pressure180.0 [mmHg]
Physical DescriptionColorless liquid; [Hawley]
物理化学的性質
- 融点
- -82.29 °C · -82.29°C
- 沸点
- 760 · bp760 64.6° (explodes)
- 比重(密度)
- 420 · d420 1.2075
- 屈折率
- 20 · nD20 1.3748
- Henry's Law Constant
- 2 · 2.0×10-2 mol/(m3Pa) at 25℃, Burkholder et al. (2019)
- 安定性
- 強力な酸化剤とは相容れない。
- EPAの化学物質情報
- Methyl nitrate (598-58-3)
化学的性質
化学的特性Colorless liquid.Slightly soluble in water; soluble inalcohol and ether.
安全と法規制
危険有害性情報
Hazards SummarySevere explosion hazard when heated or shocked; May have narcotic effects; A strong tissue irritant; [Hawley] See NITRATES and NITRITES.
DOT Hazard Classification
Methyl nitrate
Forbidden explosives/materials (49 eCFR § 173.54/§ 173.21)
安全と保護具
Protective Action Criteria (PAC)
0.85 [ppm]
9.4 [ppm]
56 [ppm]
毒性情報
Adverse EffectsMethemoglobinemia - The presence of increased methemoglobin in the blood; the compound is classified as secondary toxic effect
Toxicity DataLC50 (rat) = 1,275 ppm/4h
安全データ
- ridadr
- 0473
- hazard_class
- 1.1A
化学と産業
用途と製造
UsesUsed as a rocket propellant; [Merck Index]
Household ProductsInformation on 4 consumer products that contain Methyl nitrate in the following categories is provided:
応用分野
使用Methyl nitrate has been used as rocket propellant.
調製方法
純化方法Wash MeONO2 once with H2O then again with H2O containing a few drops of concentrated NaOH to keep it slightly alkaline (litmus). Dry the ester over anhydrous CaCl2, decant it and use it directly. It is possible to distil it under a vacuum with slow and gentle heating, as a sudden rise in temperature can cause decomposition with copious release of nitrous fumes (use extreme precautions and protection). The middle fraction can then be subjected to several freeze-pump-thaw cycles. [Black & Bakers Org Synth Col Vol II 412 1943.] [Beilstein 1 H 284, 1 I 141, 1 II 273, 1 III 1201, 1 IV 1254.] The VAPOUR CAN EXPLODE ON HEATING.
上流・下流製品情報
下流製品
サプライヤー3 社
池州凯隆进出口贸易有限公司[email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
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