Dimethyl N-cyanodithioiminocarbonate (HCID 66289)

개요

RN and structure given in first source

이름 및 식별자

우선 이름: Dimethyl N-cyanodithioiminocarbonate
IUPAC: bis(methylsulfanyl)methylidenecyanamide
영어명: N-Cyanoimido-S,S-dimethyl-dithiocarbonate
분자식: C4H6N2S2
분자량: 146.23

이름 및 동의어

10191-60-3Dimethyl cyanocarbonimidodithioateDimethyl N-cyanodithioiminocarbonateCarbonimidodithioic acid, cyano-, dimethyl esterDimethyl N-cyanoimidodithiocarbonateDimethyl cyanimidodithiocarbonateDimethyl cyanoiminodithiocarbonateS,S-Dimethyl (N-cyanoimido)dithiocarbonate9FOJ4L7GGNImidocarbonic acid, cyanodithio-, dimethyl esterNSC-145987DMCCT

이름 더 보기

N-CYANO-S,S-DIMETHYLDITHIOIMIDOCARBONATEN-Cyano-SAKOS 91434N-Cyanoimido-SN-Cyanoimido-S,S-dimα-mercaptoacetic aci

RefChem:134232233-467-6N-Cyanoimido-S,S-dimethyl-dithiocarbonateDimethyl cyanodithioiminocarbonatebis(methylsulfanyl)methylidenecyanamideDimethyl N-CyanodithiocarbonimidateS,S-Dimethyl cyanoimidodithiocarbonate(Cyanoimino)bis(methylthio)methane

데이터베이스 식별자

CAS: 10191-60-3
PubChem CID: 66289
DTXSID: DTXSID3064986
UNII: 9FOJ4L7GGN
EC Number: 233-467-6
Nikkaji: J208.415E

물성

구조 계산 물성

XLogP: 1.9
극성 표면적: 86.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 2
무거운 원자 수: 8
형식 전하: 0
복잡도: 126

물리화학적 성질

녹는점: 45 · 45-50 °C (lit.)
끓는 점: 229.6 · 229.6±23.0 °C(Predicted)
밀도: 1.298 · 1.298 (estimate)
굴절률: 1.5 · 1.5000 (estimate)
인화점: 230 °F · >230 °F
저장 조건: Inert atmosphere,Room Temperature
용해도: 메탄올에 약간 용해됩니다.
물리적 상태: 고체
산도 계수 (pKa): -5.1 · -5.10±0.50(Predicted)
BRN: 635998 · 635998
InChI: InChI=1S/C4H6N2S2/c1-7-4(8-2)6-3-5/h1-2H3
InChIKey: IULFXBLVJIPESI-UHFFFAOYSA-N
SMILES: C(=N/C#N)(/SC)\SC
NIST: N-Cyano-s,s'-dimethyldithioimido carbonate(10191-60-3)
EPA: Carbonimidodithioic acid, cyano-, dimethyl ester (10191-60-3)

화학적 성질

yellow crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301 (14.3%): Toxic if swallowed [Danger Acute toxicity, oral]

P260, P261, P262, P264, P270, P271, P272, P280, P284, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P320, P321, P330, P333+P317, P361+P364, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 49 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Status: Active Update: 10-02-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/33695

Dimethyl-N-cyanodithioiminocarbonate: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesAcute Tox. 3 (14.3%)

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: UN 1759 8/PG 2
HS 번호: 29309090
risk_code: 22-34-23/24/25-36/37
hazard_code: C,T
safety_code: 26-36/37/39-45-38-28A-7/9
포장분류: II
위험 등급: 6.1
기존화학 물질: KE-09033
F 고인화성물질: 13-19
Hazard Classifications: Acute Tox. 4 OralSkin Corr. 1B
스토리지 클래스: 8A - Combustible corrosive hazardous materials

화학 및 산업

용도 및 제조

General Manufacturing InformationCarbonimidodithioic acid, N-cyano-, dimethyl ester: INACTIVE

응용 분야 · 1건

용도Dimethyl cyanodithioiminocarbonate has been used in the synthesis of 4-methylthiopyrazolo[1,5-a]-1,3,5-triazines, methylsulfanylpyrimidines, cyanoguanidines and N-aryl-6-methylsulfanyl-4-oxopyrimidine-5-carbonitriles. It has been also used in the synthesis of methylsulfanyl derivatives of azoloazines and azoloazoles.

상·하류 제품 정보

상류 원료

하류 제품

Dicyclanil 1-시아노-3-(4-메톡시페닐)-2-메틸리소티오우레아 Cyanamide, (1,4,5,6-tetrahydro-2-pyrimidinyl)-N'-cyano-N-ethyl(methylsulfanyl)methanimidamide 4-아미노-2-메틸티오티아졸-5-탄소니트릴4-아미노-2-메틸티오티아졸-5-탄소니트릴

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

衢州润东化工有限公司0570-8789886 18892685668 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

合肥翰刚医药科技有限公司+8618062405514 · [email protected]

연결된 노트

불러오는 중…

Dimethyl N-cyanodithioiminocarbonate

기본 정보

개요