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2-Phenylbenzothiazole

2-Phenylbenzothiazole structure

2-Phenylbenzothiazole 

structure
  • CAS No:

    883-93-2

  • Formula:

    C13H9NS

  • Chemical Name:

    2-Phenylbenzothiazole

  • Synonyms:

    Benzothiazole,2-phenyl-;2-Phenylbenzothiazole;NSC 1854;NSC 2034;2-Phenylbenzo[d]thiazole;2-Phenyl-1,3-benzothiazole

  • Categories:

    Food Additives  >  Other Food Additives

Description

grey needle-like crystals

2-Phenylbenzothiazole Basic Attributes

211.282

211.28

212-935-3

FO573G4BGT

2034|1854

DTXSID80236946

29342080

Characteristics

41.1

4.3

1.2±0.1 g/cm3

115 °C

371 °C

174.4±12.1 °C

1.685

H2O: INsoluble

Safety Information

NONH for all modes of transport

3

36

S24/25

DL5990000

Xi

P305 + P351 + P338

H319

|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Drug Information

2-PBT

Computed Properties

Molecular Weight:211.28
XLogP3:4.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:211.04557046
Monoisotopic Mass:211.04557046
Topological Polar Surface Area:41.1
Heavy Atom Count:15
Complexity:213
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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