CAS 653-21-4 MFCD00004316-Pentafluorophenylacetic Acid 五氟苯基乙酸 -LabNovo

Pentafluorophenylacetic Acid 五氟苯基乙酸

CAS 653-21-4 MFCD00004316

化学结构图

SMILES: O=C(O)Cc1c(F)c(F)c(F)c(F)c1F

化学属性

Mol. Formula	C8H3F5O2
Mol. Weight	226.10
Melting Point	108-110 °C
Density	1.422
TSCA	No
Boiling Point	235.3±35.0 °C at 760 mmHg

别名和识别编码

Chemical Name	Pentafluorophenylacetic Acid
CAS Number	653-21-4
Alfabeta Name	PENTAFLUOROPHENYLACETICACID
MDL Number	MFCD00004316
PubChem Substance ID	69553
EC Number	211-497-0
Beilstein Registry Number	2056612
Reaxys-RN	2056612
Synonym	2-(Perfluorophenyl)acetic acid {LY} 2-(Perfluorophenyl)acetic acid {} {LY} 2-(Perfluorophenyl)acetic acid {} {} {LY} 2-(Perfluorophenyl)acetic acid {} {} {} {LY} 2-(Perfluorophenyl)acetic acid {} {} {} {} {LY} 2-(Perfluorophenyl)acetic acid {} {} {} {} {} {LY} 2-(Perfluorophenyl)acetic acid {} {} {} {} {} {} {LY} 2-(Perfluorophenyl)acetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(Perfluorophenyl)acetic acid {} {} {} {} {} {} {} {} {LY} 2-(Perfluorophenyl)acetic acid {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {LY} 2-(Perfluorophenyl)acetic acid {} {} {} {} {} {} {} {} {} {} {LY} 2-(Perfluorophenyl)acetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(Perfluorophenyl)acetic acid {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(Perfluorophenyl)acetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(Perfluorophenyl)acetic acid {} {}
Chemical Name Translation	五氟苯基乙酸
InChIKey	LGCODSNZJOVMHV-UHFFFAOYSA-N
LabNetwork Molecule ID	LN01328552
InChI	InChI=1S/C8H3F5O2/c9-4-2(1-3(14)15)5(10)7(12)8(13)6(4)11/h1H2,(H,14,15)
Canonical SMILES	O=C(O)CC1=C(F)C(F)=C(F)C(F)=C1F

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安全信息

Warnings IRRITANT

WGK Germany3

GHS Symbol

Precautionary statements

P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
P305+P351+P338
P305+P351+P338+P337+P313

Hazard statements

H315 Causes skin irritation 会刺激皮肤
H319 Causes serious eye irritation 严重刺激眼睛
H335 May cause respiratory irritation 可能导致呼吸道刺激

Hazard Codes Xi

Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves

Signal word

Safety Statements

S36 Wear suitable protective clothing 穿戴适当的防护服；
S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
S37 Wear suitable gloves 戴适当手套；
S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；

Risk Statements

R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性

Packing Groupn/a

Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

用途一:医药、农药、液晶材料中间体。
MOL 文件:653-21-4.mol
Hazard Note:Irritant
上游原料:氢氧化钠 --> 乙醚 --> 甲苯 --> 溴 --> 硫酸镁 --> 镁 --> 亚硫酸钠 --> 1,2,4,5-四氯苯
图谱信息:5-氟苯乙酸 (653-21-4)红外图谱(IR2) 5-氟苯乙酸 (653-21-4)红外图谱(IR1) 5-氟苯乙酸 (653-21-4)质谱(MS) 5-氟苯乙酸 (653-21-4)Raman光谱 5-氟苯乙酸 (653-21-4)核磁图( 1 HNMR)
Sigma Aldrich:653-21-4(sigmaaldrich)
TCI Shanghai:五氟苯基乙酸 Pentafluorophenylacetic Acid,>;98.0%(GC)(T)(653-21-4)
Acros Organics:2,3,4,5,6-Pentafluorphenylacetic acid, 99%(653-21-4)