2-フェニルベンゾチアゾール

2-Phenylbenzothiazole

HCID 13439CAS 883-93-2
部分構造検索類似構造を探す

基本情報

標準SMILES
c1ccc(-c2nc3ccccc3s2)cc1
InChIKey
XBHOUXSGHYZCNH-UHFFFAOYSA-N
分子式
C13H9NS
平均分子量
211.28 g/mol
単同位体質量
211.04557046

名称と識別子

優先名称
2-Phenylbenzothiazole
IUPAC
2-phenyl-1,3-benzothiazole
現地名
2-フェニルベンゾチアゾール
英語名
2-Phenylbenzothiazole
分子式
C13H9NS
分子量
211.28

名称と別名

2-Phenylbenzothiazole883-93-2BENZOTHIAZOLE, 2-PHENYL-NSC-2034FO573G4BGTDTXSID80236946NSC-1854RefChem:4781392-PBTDTXCID10159437212-935-32-Phenylbenzo[d]thiazole
名称をさらに表示
2-フェニルベンゾチアゾール2‐フェニルベンゾチアゾール2-フェニル-1,3-ベンゾチアゾールTIMTEC-BB SBB0080762-Phenylbenzthiazole2-phenyl-benzothiazol2-Phenylbenzothiazole>Benzothiazole, 2-phenyl-2-Phenylbenzothiazole,97%2-PHENYLBENZOTHIAZOLE FOR SYNTHESIS2-PHENYLBENZOTHIAZOLE SUBLIMED &
2-Phenyl-1,3-benzothiazoleMFCD00005777NSC 2034WLN: T56 BN DSJ CR2-Phenyl-1,3-benzothiazole #NSC2034HMS1424I05AC1645

データベース識別子

CAS
883-93-2
PubChem CID
13439
DTXSID
DTXSID80236946
ChEMBL
CHEMBL2272273
UNII
FO573G4BGT
EC Number
212-935-3
Nikkaji
J25.695A

物性

構造計算による物性

XLogP
4.3
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
1
重原子数
15

実験および物理化学的性質

Vapor Pressure0.00000484 [mmHg]
Physical DescriptionGrey solid; [Acros Organics MSDS]

物理化学的性質

融点
111 · 111-113 °C (lit.)
沸点
371 °C · 371 °C
比重(密度)
1.1424 · 1.1424 (rough estimate)
屈折率
1.57 · 1.5700 (estimate)
闪点
371 °C · 371°C
貯蔵温度
Keep in dark place,Sealed in dry,Room Temperature

化学的性質

化学的特性grey needle-like crystals

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.；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 InformationBenzothiazole, 2-phenyl-: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryIntraperitoneal LD50 (mouse) = 1,800 mg/kg; [RTECS] May cause irritation; [Acros Organics MSDS] See Benzothiazole.
Hazard Classes and CategoriesEye Irrit. 2 (100%)

法規制情報

Regulatory InformationBenzothiazole, 2-phenyl-: Does not have an individual approval but may be used under an appropriate group standard

安全データ

wgk
3
rtecs
DL5990000
hs_code
29342080
risk_code
36
hazard_code
Xi
safety_code
24/25-26

化学と産業

応用分野

使用2-Phenylbenzothiazole is an organic compound that was detected in water and sediment from sedimentation ponds as a contaminant.

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]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
陕西科贝莱药物研发有限公司13119135307 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

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