3,5-Difluoroaniline (HCID 96595)

개요

structure in first source

이름 및 식별자

우선 이름: 3,5-Difluoroaniline
IUPAC: 3,5-difluoroaniline
영어명: 3,5-Difluoroaniline
분자식: C6H5F2N
분자량: 129.11

이름 및 동의어

3,5-Difluoroaniline372-39-4Benzenamine, 3,5-difluoro-93F28C8C0XNSC-81289DTXSID0059906RefChem:91509DTXCID0039300206-752-83,5-DifluorobenzenamineMFCD000077633,5-difluorophenylamine

이름 더 보기

NSC 812895-Difluoroaniline3, 5-2 fluoro aniline3,5-Difluoroaniline>3,5-Difluoroaniline,98%3,5-Difluoroaniline 98%

3,5 difluoroaniline3,5-Difluoro AnilineCS-D11255ANBP-11914Q270941673,5-difluoranilin3,5-difluoroanilin

데이터베이스 식별자

CAS: 372-39-4
PubChem CID: 96595
DTXSID: DTXSID0059906
UNII: 93F28C8C0X
EC Number: 206-752-8
Nikkaji: J79.608E

물성

구조 계산 물성

XLogP: 1.4
극성 표면적: 26 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 0
무거운 원자 수: 9
형식 전하: 0
복잡도: 87.1

실험 및 물리화학적 성질

DrugsPharmaceuticals -> Listed in ZINC15

Physical DescriptionOther Solid

물리화학적 성질

녹는점: 37 · 37-41 °C (lit.)
끓는 점: 80 °C · 80°C 20mm
밀도: 1 · 1,295 g/cm3
굴절률: 1 · 1,512-1,514
인화점: 167 °F · 167 °F
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
수용성: 물에 불용성
물리적 상태: 저융점 고체
산도 계수 (pKa): 2.57 · 2.57±0.10(Predicted)
색상: 흰색에서 노란색으로
BRN: 2802286 · 2802286
InChI: InChI=1S/C6H5F2N/c7-4-1-5(8)3-6(9)2-4/h1-3H,9H2
InChIKey: KQOIBXZRCYFZSO-UHFFFAOYSA-N
SMILES: C1(N)=CC(F)=CC(F)=C1
EPA: 3 · 3,5-Difluoroaniline (372-39-4)

화학적 성질

white to yellowish low melting solid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (99.3%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 153 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Benzenamine, 3,5-difluoro- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenamine, 3,5-difluoro- 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)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Hazard Classes and CategoriesAcute Tox. 4 (99.3%)

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: UN 1325 4.1/PG 2
HS 번호: 29214200
risk_code: 20/21/22-36/37/38
hazard_code: Xn,Xi
safety_code: 28-36/37/39-26-36
포장분류: III
위험 등급: 6.1
F 고인화성물질: 8-10-23
위험 참고 사항: Irritant
Hazard Classifications: Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 Oral
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

용도 및 제조

U.S. Production2023: 250,000 - <550,000 lb

Industry UsesIntermediate

General Manufacturing Information · 2건

Pesticide, Fertilizer, and Other Agricultural Chemical Manufacturing

Benzenamine, 3,5-difluoro-: ACTIVE

응용 분야

용도3,5-Difluoroaniline has been used in the preparation of 3,5-difluorodimethylaniline.

일반 설명In vitro nephrotoxic effects of 3,5-difluoroaniline has been investigated in renal cortical slices obtained from the kidneys of untreated, male Fischer 344 rats.

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]

INTATRADE GmbH+49 3493/605464 · [email protected]

연결된 노트

불러오는 중…

3,5-Difluoroaniline

기본 정보

개요