2-Nitro-4-(trifluoromethyl)phenol (HCID 9816)

이름 및 식별자

우선 이름: 2-Nitro-4-(trifluoromethyl)phenol
IUPAC: 2-nitro-4-(trifluoromethyl)phenol
영어명: 4-Hydroxy-3-nitrobenzotrifluoride
분자식: C7H4F3NO3
분자량: 207.11

이름 및 동의어

2-Nitro-4-(trifluoromethyl)phenolPhenol, 2-nitro-4-(trifluoromethyl)-BRN 2215510EINECS 206-927-9DTXSID6059946XZEDEVRSUANQEM-UHFFFAOYSA-4-06-00-02150 (Beilstein Handbook Reference)RefChem:88674DTXCID2039704206-927-9InChI=1/C7H4F3NO3/c8-7(9,10)4-1-2-6(12)5(3-4)11(13)14/h1-3,12HXZEDEVRSUANQEM-UHFFFAOYSA-N

이름 더 보기

4-Hydroxy-3-nitrobenalpha,alpha,alpha-trifluoro-22-nitro-4-trifluoromethlphenol5-Nitro-2-trifluoromethyl-phenol2-Nitro-4-(trifluormethyl)phenol2-nitro-4-(trifluoromethyl)-pheno4-HYDROXY-3-NITROBENZOTRIFLUOROIDE3-nitro-4-hydroxy-benzotrifluoride

400-99-74-Hydroxy-3-nitrobenzotrifluorideMFCD000097912-Nitro-4-Trifluoromethylphenol2-nitro-4-trifluoromethyl-phenol2-Nitro-alpha,alpha,alpha-trifluoro-p-cresolCU9AQU8UALp-Cresol, 2-nitro-alpha,alpha,alpha-trifluoro-

데이터베이스 식별자

CAS: 400-99-7
PubChem CID: 9816
DTXSID: DTXSID6059946
UNII: CU9AQU8UAL
EC Number: 206-927-9
Nikkaji: J118.439C

물성

구조 계산 물성

XLogP: 2.3
극성 표면적: 66.1 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 6
회전 가능 결합 수: 0
무거운 원자 수: 14
형식 전하: 0
복잡도: 225

물리화학적 성질

끓는 점: 92 · 92-94 °C12 mm Hg(lit.)
밀도: 1.473 g/mL · 1.473 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.504(lit.)
인화점: 203 °F · 203 °F
저장 조건: Inert atmosphere,Room Temperature
물리적 상태: 액체
산도 계수 (pKa): 5.53 · 5.53±0.14(Predicted)
색상: 노란색에서 주황색으로
BRN: 2215510 · 2215510
InChI: 1S/C7H4F3NO3/c8-7(9,10)4-1-2-6(12)5(3-4)11(13)14/h1-3,12H
InChIKey: XZEDEVRSUANQEM-UHFFFAOYSA-N
SMILES: Oc1ccc(cc1[N+]([O-])=O)C(F)(F)F
EPA: 2 · Phenol, 2-nitro-4-(trifluoromethyl)- (400-99-7)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

Aggregated GHS information provided per 47 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.9%)

안전 데이터

wgk: 3
tsca: TSCA listed
rtecs: GP2984950
독성: LD50 ipr-mus: 800 mg/kg JPMSAE 57,1763,68
HS 번호: 29089990
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-37/39-36
위험 등급: IRRITANT
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 10 - Combustible liquids

화학 및 산업

용도 및 제조

General Manufacturing InformationPhenol, 2-nitro-4-(trifluoromethyl)-: INACTIVE

응용 분야

용도2-Nitro-4-(trifluoromethyl)phenol has been used in the synthesis of 2-methyl-2-[2-nitro-4-(trifluoromethyl)phenoxy]propionic acid ethyl ester.

일반 설명2-Nitro-4-(trifluoromethyl)phenol is the major product of solution phase photodecomposition of fluorodifen.

상·하류 제품 정보

상류 원료

4-Amino-3-nitrobenzotrifluoride 수산화나트륨 염산 4-클로로-3-니트로벤조트리플루오르화물 메틸알콜 2-메톡시 에탄올 4-Trifluoromethylphenol 염화벤잘코늄

하류 제품

프로로(4-)-3니트로벤조트리풀로라이드 2-아미노-알파,알파,알파-트리플루오로-p-크레소 밥타크120/07-77

공급사50 곳

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

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

宁波振岳医药科技有限公司19817745290 · [email protected]

上海衡新化工科技有限公司13917104483; 13917104483 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

연결된 노트

불러오는 중…

2-Nitro-4-(trifluoromethyl)phenol

기본 정보