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4,4'-ジチオジモルホリン

Dtdm

HCID 7648
ノート反応
基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
部分構造検索類似構造を探す

基本情報

CAS
103-34-4
標準SMILES
C1CN(SSN2CCOCC2)CCO1
InChIKey
HLBZWYXLQJQBKU-UHFFFAOYSA-N
分子式
C8H16N2O2S2
平均分子量
236.4 g/mol
単同位体質量
236.0653201

概要

rubber vulcanizing agent causing occupational dermatitis; structure

名称と識別子

優先名称
Dtdm
IUPAC
4-(morpholin-4-yldisulfanyl)morpholine
現地名
4,4'-ジチオジモルホリン
英語名
4,4'-Dithiodimorpholine
分子式
C8H16N2O2S2
分子量
236.35

名称と別名

4,4'-DITHIODIMORPHOLINE103-34-4Morpholine, 4,4'-dithiobis-Morpholine disulfideAccel R4,4'-DithiomorpholineMorpholino disulfideDimorpholine disulfideDimorpholino disulfideDeovulc MSanfel RBismorpholino disulfide
名称をさらに表示
4,4'-ジチオジモルホリンジモルホリノペルジスルフィドビスモルホリノペルスルフィドジモルホリノペルスルフィド4,4'-ジチオビスモルホリンビス(モルホリン-4-イル)ペルスルフィドモルホリンジスルフィド4,4′-ジチオジモルホリンN,N′-二硫化ジモルホリンジチオジモルホリン4,4’ジチオジモルホリンN,N'-ジチオビス(モルホリン)N,N'-ジモルホリンジスルフィド4,4’-ジチオジモルホリン4,4′‐ジチオジモルホリン二硫化N,N'-ジモルホリンDTDM1,2-diMorpholinodisulfane4,4'-daccelrsanfelrdeovulcmusafb-17
DithiobismorpholineMorpholinodisulfideVanax ADisulfide, dimorpholino-Usaf ek-t-6645Usaf B-17Vulnoc4,4'-Dithiobismorpholine

物性

構造計算による物性

XLogP
0.6
極性表面積
75.5 Ų
水素結合供与体数
0
水素結合受容体数
6
回転可能結合数
3
重原子数
14
形式電荷
0
複雑度
143

実験および物理化学的性質

Chemical ClassesNitrogen Compounds -> Morpholines
Density1.36 @ 25 °C
Color/Form · 2 件

CRYSTALS

GRAY TO TAN POWDER

Flash Point · 2 件

121 °C

250 °F (MINIMUM)

Melting Point125 °C
Vapor Pressure0.0000305 [mmHg]
Food Contact Substances · 2 件

FCS -> FDA Cumulative Estimated Daily Intake (CEDI)

FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR

Physical Description · 2 件

Dry Powder; Large Crystals; Large Crystals; Dry Powder

Gray to tan solid; [Hawley] White solid; [MSDSonline]

物理化学的性質

融点
124 · 124-125°C
沸点
371.7 · 371.7±52.0 °C(Predicted)
比重(密度)

安全と法規制

安全情報は参考情報です。供給元の安全データシート(SDS)、適用法令、専門家による評価に代わるものではありません。

GHS分類

GHS Classification · 4 件

Warning

H315 (10.3%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P272, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 184 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory Information · 4 件

Chemical: Morpholine, 4,4'-dithiobis-

Morpholine, 4,4'-dithiobis- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Morpholine, 4,4'-dithiobis- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

REACH registered substance: Di(morpholin-4-yl) disulphide (EC: 203-103-0)

Morpholine, 4,4'-dithiobis-: Does not have an individual approval but may be used under an appropriate group standard

Hazards Summary · 1 件

Effects in high-dose feeding studies of rats include anemia and liver changes; Emergency treatment: Morpholine; Morpholine is an irritant that can cause corneal damage; Liver and kidney injury occur in lethal-dose studies of laboratory animals; [HSDB] Causes abnormal liver function tests in feeding studies of rats; [RTECS] Not irritating to skin but irritating to eyes in rabbits; Not sensitizing; Decrease in fetal viability and body weight, and minor increase in malformed fetuses at materno-toxic doses; Not mutagenic; [EPA Hazard Characterization Document] Irritating but not sensitizing in patch test with ten volunteers; [EPA HPVIS] May cause irritation; [Aldrich MSDS]

Hazard Classes and CategoriesSkin Irrit. 2 (10.3%)
Explosive Limits and Potential

化学と産業

用途と製造

Uses · 6 件

Used as a stain protector for rubber, a vulcanizer (sulfur donor) and accelerator for natural and synthetic rubbers, a fungicide, and a curing agent for poly(fluoroalkoxyphosphazenes); [HSDB]

Farming (Pesticides) [Category: Industry]

STAINING PROTECTOR IN RUBBER; IN VULCANIZATION OF RUBBER; FUNGICIDE

ORGANOSULFUR ACCELERATOR

ACCELERATOR FOR NATURAL & SYNTHETIC RUBBERS

VULCANIZER (SULFUR DONOR) FOR NATURAL & SYNTHETIC RUBBERS

U.S. Exports · 2 件

(1979) No Data

(1981) No Data

U.S. Imports · 2 件

(1979) No Data

(1981) No Data

U.S. Production · 3 件

2023: 550,000 - <700,000 lb

(1979) PROBABLY GREATER THAN 4.54X10+5 GRAMS

(1981) PROBABLY GREATER THAN 4.54X10+5 GRAMS

Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesOther
Methods of Manufacturing · 2 件

BLAKE, J AM CHEM SOC 65, 1267 (1943); BLAKE, US PATENT 2,343,524 (1944 TO MONSANTO); HARMAN, US PATENT 2,766,236 AND BRITISH PATENT 774,570 (1956, 1957, BOTH TO MONSANTO). LAMBRECH ET AL, US PATENT 2,902,402 (1959 TO PFIZER). ... AS FUNGICIDE: LADD, US PATENT 2,429,097 (1949 TO US RUBBER).

OXIDATIVE COUPLING OF 4-THIOMORPHOLINE WITH MOLECULAR OXYGEN IN THE PRESENCE OF AN AQUEOUS CAUSTIC AGENT & CATALYST

General Manufacturing Information · 2 件

Wholesale and Retail Trade

Morpholine, 4,4'-dithiobis-: ACTIVE

調製方法

Crystallise it from hot aqueous dimethylformamide or EtOH. It is a fungicide. [Blake J Am Chem Soc 65 1267 1943.]

関連反応

0 件
反応記録を作成

現在のフィルター条件では反応記録がありません。

化合物ノート

読み込み中…

このページの内容基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート

データベース識別子

CAS
103-34-4
PubChem CID
7648
DTXSID
DTXSID8026698
ChEMBL
CHEMBL582932
UNII
M786P489YF
EC Number
203-103-0
Nikkaji
J22.138D
1.32 · 1.32~1.38g/cm3
蒸気圧
0.004 Pa · 0.004Pa at 25℃
屈折率
1.63 · 1.6300 (estimate)
貯蔵温度
Refrigerator
外見
powder to crystaline
酸解離定数(Pka)
0.78 · 0.78±0.20(Predicted)
色
White to Almost white
比重
1.36 · 1.36
水溶解度
215 mg/L · 215mg/L at 20.2℃
Merck
14 · 14,3372
InChIKey
HLBZWYXLQJQBKU-UHFFFAOYSA-N
LogP
2.67 at · 2.67 at 22℃
CAS データベース
103 · 103-34-4(CAS DataBase Reference)
NISTの化学物質情報
Morpholine disulfide(103-34-4)
EPAの化学物質情報
4 · Morpholine, 4,4'-dithiobis- (103-34-4)
THE PRODUCT FROM CHLORINATION OF 4,4'-DITHIODIMORPHOLINE EXPLODED VIOLENTLY AFTER VACUUM STRIPPING OF THE SOLVENT CARBON TETRACHLORIDE.

毒性情報

Adverse EffectsOccupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.
Human Toxicity Excerpts4,4'-DITHIODIMORPHOLINE INDUCED DERMATITIS OF VARIOUS DEGREES OF SPREADING ACCORDING TO THE MODE OF EXPOSURE.
Non-Human Toxicity ExcerptsCHRONIC ORAL ADMIN OF N,N'-DITHIODIMORPHOLINE RETARDED RAT GROWTH, DECR BLOOD HEMOGLOBIN AND ERYTHROCYTE LEVELS, INHIBITED BLOOD CATALASE & PEROXIDASE, AND CAUSED DESTRUCTIVE-DYSTROPHIC CHANGES IN THE SPLEEN, LIVER, AND OTHER ORGANS.
Toxicity DataLC50 (mice) = 1,624 mg/m3/4h

安全データ

tsca
TSCA listed
rtecs
QE3325000
hs_code
2934.99.9001
risk_code
36/37/38
化審法
(5)-892
safety_code
26-36/37/39
有毒物質データの
103-34-4(Hazardous Substances Data)
純化方法

上流・下流製品情報

上流原料

ジクロロペルスルフィド

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