2-メチルベンゾチアゾール

2-Methylbenzothiazole

HCID 8446CAS 120-75-2
部分構造検索類似構造を探す

基本情報

標準SMILES
Cc1nc2ccccc2s1
InChIKey
DXYYSGDWQCSKKO-UHFFFAOYSA-N
分子式
C8H7NS
平均分子量
149.21 g/mol
単同位体質量
149.0299204

名称と識別子

優先名称
2-Methylbenzothiazole
IUPAC
2-methyl-1,3-benzothiazole
現地名
2-メチルベンゾチアゾール
英語名
2-Methylbenzothiazole
分子式
C8H7NS
分子量
149.21

名称と別名

2-Methylbenzothiazole120-75-2Benzothiazole, 2-methyl-2-methyl-benzothiazole2-METHYBENZOTHIAZOLEUSAF EK-18532-Methyl benzothiazoleUNII-7LX1XE6H8WDTXSID8049208BRN 0112427NSC 3825EINECS 204-423-3
名称をさらに表示
2-メチルベンゾチアゾール2‐メチルベンゾチアゾール2-メチル-1,3-ベンゾチアゾール2-methylbenzo[d]thiazoleMETHYLBENZOTHIAZOLE2-Methyl-1,3-benzothiazoleusafek-18532-Methylbenzothiazo2-methylbenzothiazol2-methyl-benzothiazol3-Methyl-benzothiazole
7LX1XE6H8WCCRIS 8096NSC-3825DTXCID40290644-27-00-01080 (Beilstein Handbook Reference)RefChem:88264204-423-3DXYYSGDWQCSKKO-UHFFFAOYSA-N

データベース識別子

CAS
120-75-2
PubChem CID
8446
DTXSID
DTXSID8049208
ChEMBL
CHEMBL2393325
UNII
7LX1XE6H8W
EC Number
204-423-3
Nikkaji
J37.318D

物性

構造計算による物性

XLogP
3
極性表面積
41.1 Ų
水素結合供与体数
0
水素結合受容体数
2
回転可能結合数
0
重原子数
10

実験および物理化学的性質

Boiling Point238.00 °C. @ 760.00 mm Hg
Melting Point14 °C
Physical DescriptionLiquid
Kovats Retention Index1288；1273

物理化学的性質

融点
11 · 11-14 °C (lit.)
沸点
238 °C · 238 °C (lit.)
比重(密度)
1.173 g/mL · 1.173 g/mL at 25 °C (lit.)
屈折率
20 · n20/D 1.617(lit.)
闪点
216 °F · 216 °F
貯蔵温度
Inert atmosphere,Room Temperature

化学的性質

化学的特性clear colorless to light amber liquid

安全と法規制

GHS分類

GHS Classification · 3 件

This chemical does not meet GHS hazard criteria for 95% (38 of 40) of all reports.

Not Classified；Reported as not meeting GHS hazard criteria by 38 of 40 companies (only 5% companies provided GHS information). For more detailed information, please visit ECHA C&L website.

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 38 of 40 reports by companies.；There are 2 notifications provided by 2 of 40 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

危険有害性情報

Regulatory Information · 3 件

Chemical: Benzothiazole, 2-methyl-

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

Benzothiazole, 2-methyl-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesNot Classified

法規制情報

Regulatory Information · 3 件

Chemical: Benzothiazole, 2-methyl-

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

Benzothiazole, 2-methyl-: Does not have an individual approval but may be used under an appropriate group standard

安全データ

wgk
3
tsca
TSCA listed
rtecs
DL5600000
hs_code
29342080
risk_code
36/37/38-20/21/22
化審法
(5)-228

化学と産業

薬理情報

Cellular LocationsMembrane

用途と製造

General Manufacturing InformationBenzothiazole, 2-methyl-: ACTIVE

応用分野

使用2-Methylbenzothiazole is a useful reagent for efficient development of new fluorescent probes for RNA G quadruplex imaging.

一般的な説明2-Methylbenzothiazole can be synthesized by the Cu-catalyzed, base-free C-S coupling using conventional and microwave heating methods.

上流・下流製品情報

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]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]

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