基本情報
- 標準SMILES
O=N[O-]- InChIKey
IOVCWXUNBOPUCH-UHFFFAOYSA-M- 分子式
- NO2-
- 平均分子量
- 46.006 g/mol
- 単同位体質量
- 45.99345182
概要
Nitrites, inorganic, n.o.s. appears as colorless solutions or crystalline solids. Denser than water. Contact may cause irritation to skin, eyes, and mucous membranes. May be toxic by ingestion. Used to make other chemicals.
名称と識別子
- 優先名称
- Nitrite
- IUPAC
- nitrite
名称と別名
名称をさらに表示
データベース識別子
- CAS
14797-65-0- PubChem CID
- 946
- DTXSID
DTXSID5024219- ChEBI
CHEBI:16301- UNII
- J39976L608
- Nikkaji
- J95.225G
物性
構造計算による物性
- XLogP
- -0.8
- 極性表面積
- 52.5 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
- 3
- 形式電荷
- -1
- 複雑度
- 7.5
実験および物理化学的性質
安全と法規制
危険有害性情報
Regulatory Information
Hazard Traits - Hematotoxicity
Regulation (EC) No 257/2010
Reactivity Profile
NITRITES, INORGANIC, N.O.S. are oxidizing agents. React with acids to form toxic nitrogen dioxide gas. A violent explosion occurs if an ammonium salt is melted with a nitrite salt [Von Schwartz 1918. p 299]. A mixture with potassium cyanide may cause an explosion [Pieters 1957. p. 30].
DOT Hazard Classification
Nitrites, inorganic, aqueous solution, n.o.s
UN3219
Div 5.1 Oxidizer (49 eCFR § 173.127)
PG II: the degree of danger presented by the material is medium
Symbol G: The proper shipping name for which one or more technical names of the hazardous material must be entered in parentheses, in association with the basic description. (49 eCFR §172.203(k))
Nitrites, inorganic, n.o.s.
安全と保護具
毒性情報
Treatment
Methemoglobinemia can be treated with supplemental oxygen and methylene blue 1% solution administered intravenously slowly over five minutes followed by IV flush with normal saline. Methylene blue restores the iron in hemoglobin to its normal (reduced) oxygen-carrying state. (L1613)
Toxicity Summary
Nitrite causes the autocatalytic oxidation of oxyhemoglobin to hydrogen peroxide and methemoglobin. This elevation of methemoglobin levels is a condition known as methemoglobinemia, and is characterized by tissue hypoxia, as methemoglobin cannot bind oxygen. (A2450, L1613)
Signs and Symptoms
Nitrite poisoning causes methemoglobinemia. Symptoms include cyanosis, cardiac dysrhythmias and circulatory failure, and progressive central nervous system (CNS) effects. CNS effects can range from mild dizziness and lethargy to coma and convulsions. (L1137)
EPA IRIS Information
Nitrite
Hematologic
1 x 10 ^-1 mg/kg-day
RAIS Toxicity Values
0.1
ATSDR Final
0.1
IRIS Current
0.1
ATSDR Final
USGS Health-Based Screening Levels for Evaluating Water-Quality
Nitrogen, Nitrite
00613
Nutrient
1000
Nitrite (as N)
Smith, C.D. and Nowell, L.H., 2024. Health-Based Screening Levels for evaluating water-quality data (3rd ed.). DOI:10.5066/F71C1TWP
Hazard Quotient Level 0.1 or Cancer Risk Level 1E-06
7.80e+03
1.20e+05
2.00e+03
1.00e+03
1.00e-01
Volatile
Hazard Quotient Level 3 or Cancer Risk Level 1E-04
2.30e+04
3.50e+05
6.00e+03
1.00e+03
1.00e-01
Volatile
化学と産業
薬理情報
Metabolism/Metabolites
Intake of some amount of nitrates and nitrites is a normal part of the nitrogen cycle in humans. In vivo conversion of nitrates to nitrites can occur in the gastrointestional tract under the right conditions, significantly enhancing nitrates' toxic potency. The major metabolic pathway for nitrate is conversion to nitrite, and then to ammonia. Nitrites, nitrates, and their metabolites are excreted in the urine. (L1137)
用途と製造
関連反応
関連ノート
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