4-(トリフルオロメトキシ)フェニルヒドラジン塩酸塩

4-(Trifluoromethoxy)phenylhydrazine hydrochloride

HCID 2777328

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 133115-72-7
標準SMILES: Cl.NNc1ccc(OC(F)(F)F)cc1
InChIKey: KQXZVSQCMVKMBK-UHFFFAOYSA-N
分子式: C7H8ClF3N2O
平均分子量: 228.6 g/mol
単同位体質量: 228.02772522

名称と識別子

優先名称: 4-(Trifluoromethoxy)phenylhydrazine hydrochloride
IUPAC: [4-(trifluoromethoxy)phenyl]hydrazine;hydrochloride
現地名: 4-(トリフルオロメトキシ)フェニルヒドラジン塩酸塩
英語名: 4-(Trifluoromethoxy)phenylhydrazine hydrochloride
分子式: C7H7F3N2O.ClH
分子量: 228.6

名称と別名

133115-72-74-(Trifluoromethoxy)phenylhydrazine hydrochlorideDTXSID80380478RefChem:289512DTXCID60331504626-079-7(4-(trifluoromethoxy)phenyl)hydrazine hydrochloride[4-(trifluoromethoxy)phenyl]hydrazine hydrochlorideMFCD000530334-trifluoromethoxyphenylhydrazine hydrochloride4-(trifluoromethoxy)phenylhydrazine hclHydrazine, [4-(trifluoromethoxy)phenyl]-, hydrochloride (1:1)

名称をさらに表示

4-(トリフルオロメトキシ)フェニルヒドラジン塩酸塩4‐(トリフルオロメトキシ)フェニルヒドラジン塩酸塩4-(トリフルオロメトキシ)フェニルヒドラジン塩酸塩SBB003295366951_ALDRICHBUTTPARK 44\57-15TIMTEC-BB SBB0032954-trifluoromethylbenzene hydrazind HCl(4-TRIFLUOROMETHOXYPHENYL)-HYDRAZINE HCLTRIFLUOROMETHOXY)PHENYLHYDRAZINE HYDROCHLORIDEp-trifluoromethoxy phenylhydrazine hydrochloride4-(Trifluoromethoxy)phenylhydrazinehydrochloride97%

[4-(trifluoromethoxy)phenyl]hydrazine;hydrochlorideAC-4208SB795754-trifluoromethoxy phenylhydrazine hydrochloride(4-(trifluoromethoxy)phenyl)-hydrazine hydrochlorideHydrazine, [4-(trifluoromethoxy)phenyl]-, monohydrochlorideAM20060207SCHEMBL508110

データベース識別子

CAS: 133115-72-7
PubChem CID: 2777328
DTXSID: DTXSID80380478
EC Number: 626-079-7

物性

構造計算による物性

極性表面積: 47.3 Å²
水素結合供与体数: 3
水素結合受容体数: 6
回転可能結合数: 2
重原子数: 14
形式電荷: 0
複雑度: 154

物理化学的性質

融点: 230 °C · 230 °C(lit.)
貯蔵温度: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
水溶解度: Soluble in water
外見: 粉
色: 白色～薄茶色
InChI: InChI=1S/C7H7F3N2O.ClH/c8-7(9,10)13-6-3-1-5(12-11)2-4-6;/h1-4,12H,11H2;1H
InChIKey: KQXZVSQCMVKMBK-UHFFFAOYSA-N
SMILES: C1(OC(F)(F)F)C=CC(NN)=CC=1.Cl
CAS データベース: 133115 · 133115-72-7(CAS DataBase Reference)

化学的性質

化学的特性white to light yellow crystal powde

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H302 (75%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 64 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (75%)

安全データ

wgk: 3
hs_code: 29280000
risk_code: 20/21/22-36/37/38
hazard_code: Xn,Xi
safety_code: 26-36
hazard_class: IRRITANT
Hazard Classifications: Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
ストレージクラス: 11 - Combustible Solids