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2-Bromobenzyl mercaptan

2-Bromobenzyl mercaptan structure

2-Bromobenzyl mercaptan 

structure
  • CAS No:

    143888-85-1

  • Formula:

    C7H7BrS

  • Chemical Name:

    2-Bromobenzyl mercaptan

  • Synonyms:

    2-BROMOBENZYLMERCAPTAN;(2-Bromobenzyl);2-Bromobenzyl mercap;(2-broMophenyl)Methanethiol;2-Bromobenzylthiol

2-Bromobenzyl mercaptan Basic Attributes

203.1

201.945175

DTXSID00378630

29309090

Characteristics

1

3.51

1.527 g/mL at 25 °C(lit.)

256-257 °C(lit.)

>230 °F

n 20/D 1.6170(lit.)

0.0211mmHg at 25°C

Safety Information

III

6.1

UN2810

3

36/37/38-20/21/22

23-24/25-36/37/38-20/21/22

Xi

Irritant

P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, P501

H301+H311+H331

|Danger|H301+H311+H331 (16.67%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 6 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:203.10
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:201.94518
Monoisotopic Mass:201.94518
Topological Polar Surface Area:1
Heavy Atom Count:9
Complexity:85
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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