4-Fluoro-N-methylaniline

4-FLUORO-N-TOLUIDINE · p-Fluoro-N-methylaniline · N-Methyl-4-fluoroaniline · 4-Fluoro-N-methylaniline · 4-FLUORO-N-METHYLANILINE 98% · 4-Fluoro-N-MethylbenzenaMine · 4-Fluoro-N-methylaniline ,98% · Benzenamine, 4-fluoro-N-methyl-

https://huagongshe.com/ko/chemical/68024

식별자 및 물리적 특성

CAS No.	459-59-6
분자식	C7H8FN
평균 분자량	125.14 g/mol
단동위원소 질량	125.06407748 g/mol
SMILES	CNc1ccc(F)cc1
InChIKey	VLWRKVBQUANIGI-UHFFFAOYSA-N
PubChem CID	68024
EC No.	207-294-1
DTXSID	DTXSID3022033

화학 및 물리적 성질

XLogP	2.3
극성 표면적	12
수소 결합 공여자 수	1
수소 결합 수용자 수	2
회전 가능 결합 수	1
무거운 원자 수	9
형식 전하	0
복잡도	77
SpringerMaterials Properties	Molecular structure
끓는 점	79 °C/11 mmHg (lit.)
밀도	1.040 g/mL at 25 °C (lit.)
굴절률	n20/D 1.5320(lit.)
인화점	168 °F
저장 조건	Keep in dark place,Sealed in dry,Room Temperature
pKa(산도 계수)	4.80±0.12(Predicted)
InChI	1S/C7H8FN/c1-9-7-4-2-6(8)3-5-7/h2-5,9H,1H3
InChIKey	VLWRKVBQUANIGI-UHFFFAOYSA-N
SMILES	CNc1ccc(F)cc1
EPA	Benzenamine, 4-fluoro-N-methyl- (459-59-6)

화학적 성질

clear yellowish liquid

안전 및 규제

GHS 분류	DangerH301 (97.6%): Toxic if swallowed [Danger Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P272, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and Categories	Acute Tox. 3 (97.6%)
수질 위해 등급(WGK)	2
운송 번호(UN)	UN 2810 6.1/PG 3
관세 코드	29214300
위험 문구(R)	22-37/38-41-43-52/53
위험 표시	Xn,Xi
안전 문구(S)	26-36/37/39
위험 등급	6.1Acute Tox. 3 OralEye Dam. 1Skin Irrit. 2Skin Sens. 1STOT SE 3
저장 분류	6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

용도

4-Fluoro-N-methylaniline was used as a model compound to study the in vivo and in vitro biotransformation of secondary aromatic amines.