N-메틸-비스(트리플루오로아세트아미드)

N-Methylbis(trifluoroacetyl)imide

HCID 69635

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 685-27-8
표준 SMILES: CN(C(=O)C(F)(F)F)C(=O)C(F)(F)F
InChIKey: AWGBWLXGUPTXHF-UHFFFAOYSA-N
분자식: C5H3F6NO2
평균 분자량: 223.07 g/mol
단동위원소 질량: 223.00679731

이름 및 식별자

우선 이름: N-Methylbis(trifluoroacetyl)imide
IUPAC: 2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)acetamide
현지명: N-메틸-비스(트리플루오로아세트아미드)
영어명: N-Methyl-bis(trifluoroacetamide)
분자식: C5H3F6NO2
분자량: 223.07

이름 및 동의어

685-27-8N-Methyl-bis(trifluoroacetamide)2,2,2-Trifluoro-N-methyl-N-(trifluoroacetyl)acetamideAcetamide, 2,2,2-trifluoro-N-methyl-N-(trifluoroacetyl)-N-Methylbis(trifluoroacetyl)imideDTXSID00218623RefChem:830690DTXCID50141114211-680-5MBTFAN-Methylbis(trifluoroacetamide)2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)acetamide

이름 더 보기

N-메틸-비스(트리플루오로아세트아미드)N-Methylbis(Tr[Trifluoroacylating Agent]Florists Sendranthema ExtractN-MethylbistrifluororacetamideN-Methylbis(trifluoroacetyl)amineN-METHYL-N-BIS(TRIFLUOROACETAMIDE)N-Methylbis(trifluoroacetamide)98%

N,N-Bis(trifluoroacetyl)methylamineMFCD00000412n-methyl-bis-trifluoroacetamideAcetamide, 2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)-C5H3F6NO2EINECS 211-680-5R7BG7A7NBBSCHEMBL9004789

데이터베이스 식별자

CAS: 685-27-8
PubChem CID: 69635
DTXSID: DTXSID00218623
UNII: R7BG7A7NBB
EC Number: 211-680-5
Nikkaji: J149.964E

물성

구조 계산 물성

XLogP: 1.7
극성 표면적: 37.4 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 8
회전 가능 결합 수: 0
무거운 원자 수: 14
형식 전하: 0
복잡도: 228

실험 및 물리화학적 성질

Chemical ClassesNitrogen Compounds -> Other Nitrogen Compounds

SpringerMaterials Properties19F nuclear magnetic resonance spectrum

Physical DescriptionClear colorless liquid; [Sigma-Aldrich MSDS]

물리화학적 성질

끓는 점: 121 · 121-122 °C(lit.)
밀도: 1.547 g/mL · 1.547 g/mL at 25 °C
굴절률: 20 · n20/D 1.346(lit.)
인화점: 42 °C · 42 °C
저장 조건: 2 · 2-8°C
산도 계수 (pKa): -3.38 · -3.38±0.70(Predicted)
물리적 상태: 투명한 액체
색상: 무색~연황색
Specific Gravity: 1.547 · 1.547
BRN: 1878402 · 1878402
InChI: 1S/C5H3F6NO2/c1-12(2(13)4(6,7)8)3(14)5(9,10)11/h1H3
InChIKey: AWGBWLXGUPTXHF-UHFFFAOYSA-N
SMILES: CN(C(=O)C(F)(F)F)C(=O)C(F)(F)F
NIST: 2 · Acetamide, 2,2,2-trifluoro-n-methyl-n-(trifluoroacetyl)-(685-27-8)

화학적 성질

clear colorless liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 43 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information2,2,2-Trifluoro-N-methyl-N-(trifluoroacetyl)acetamide: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryCauses burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; [Sigma-Aldrich MSDS] See Fluoroacetamide. See Chloroacetamide.

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

독성 정보

Adverse EffectsDermatotoxin - Skin burns.

안전 데이터

wgk: 3
ridadr: UN 2920 8/PG 2
HS 번호: 29241990
risk_code: 10-34-44
hazard_code: C
safety_code: 26-36/37/39-45-16
포장분류: II
위험 등급: 8
F 고인화성물질: 10-21
위험 참고 사항: Corrosive/Moisture Sensitive
Hazard Classifications: Flam. Liq. 3Skin Corr. 1B
스토리지 클래스: 3 - Flammable liquids

화학 및 산업

응용 분야

용도Reagent for introducing trifluoroacetyl group.

상·하류 제품 정보

하류 제품

PHENYL TRIFLUOROACETATE

공급사73 곳

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

阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]

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

韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

화합물 노트

불러오는 중…