tert-BUTYL CHLORIDE

HCID 10486CAS 507-20-0

基本情報

標準SMILES: CC(C)(C)Cl
InChIKey: NBRKLOOSMBRFMH-UHFFFAOYSA-N
分子式: C4H9Cl
平均分子量: 92.57 g/mol
単同位体質量: 92.03927797

名称と識別子

優先名称: tert-BUTYL CHLORIDE
IUPAC: 2-chloro-2-methylpropane
英語名: tert-Butyl chloride
分子式: C4H9Cl
分子量: 92.56726

名称と別名

2-Chloro-2-methylpropane507-20-0tert-Butyl chloridePropane, 2-chloro-2-methyl-TrimethylchloromethaneChlorotrimethylmethanetert-Butylchloride2-Chloroisobutanet-Butylchloride2-Methyl-2-chloropropane2-Methyl-2-propyl chlorideNSC 6527

名称をさらに表示

DTXSID2023937EINECS 208-066-4JN2YO95TZ0BRN 1730872CCRIS 9388AI3-30754NSC-6527BUTYL CHLORIDE, TERT-

データベース識別子

CAS: 507-20-0
PubChem CID: 10486
DTXSID: DTXSID2023937
ChEMBL: CHEMBL346997
UNII: JN2YO95TZ0
EC Number: 208-066-4
Nikkaji: J2.614J

物性

構造計算による物性

XLogP: 1.8
極性表面積: 0 Å²
水素結合供与体数: 0
水素結合受容体数: 0
回転可能結合数: 0
重原子数: 5
形式電荷: 0
複雑度: 25.1

実験および物理化学的性質

Chemical ClassesFlammable agents - 3rd degree

SolventsSolvents -> Chlorinated Aliphatics

SpringerMaterials PropertiesDunham energy parameter

PesticidesPesticide -> EPA IRIS

LogP1.82

Density0.87 @25 °C

物理化学的性質

融点: -26 °C · -26 °C
沸点: 50.9 °C · 50.9 °C
比重(密度): 0.8511 g/cm3 · 0.8511 g/cm3

安全と法規制

GHS分類

GHS Classification · 6 件

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 93 reports by companies from 5 notifications to the ECHA C&L Inventory.

Danger

H225: Highly Flammable liquid and vapor [Danger Flammable liquids]

危険有害性情報

Regulatory Information · 4 件

Chemical: Propane, 2-chloro-2-methyl-

Status: Active Update: 10-02-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/23807

2-Chloro-2-methylpropane: Does not have an individual approval but may be used under an appropriate group standard

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

Hazards Summary · 1 件

Symptoms possibly indicative of neurotoxicity (disturbed coordination, reduced motility, hunched posture, etc.) observed in oral lethal-dose study of rats; [EPA - TSCATS] May cause irritation; [Sigma-Aldrich MSDS] See 2-Chlorobutane and n-Butyl chloride.

Hazard Classes and Categories · 3 件

Flam. Liq. 2 (100%)

Flammable liquids - Category 2

Flammable agents - 3rd degree

安全と保護具

Protective Action Criteria (PAC) · 3 件

8.7 [mg/m3]

96 [mg/m3]

570 [mg/m3]

毒性情報

Adverse EffectsNeurotoxin - Acute solvent syndrome

EPA IRIS Informationt-Butylchloride

化学と産業

用途と製造

UsesUsed as an intermediate in synthesis; EPA - TSCATS] Used to make fine chemicals; [ECHA REACH Registrations]

General Manufacturing InformationPropane, 2-chloro-2-methyl-: ACTIVE

サプライヤー50 社

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]

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

合肥翰刚医药科技有限公司+8618062405514 · [email protected]

济南氟泽新材料有限公司00-15169181 15169181281 · [email protected]