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4-bromo-2-tert-butyl-1,1-dioxo-1,2-thiazol-3-one

4-bromo-2-tert-butyl-1,1-dioxo-1,2-thiazol-3-one structure

CAS No:
126623-65-2
Formula:
C7H10BrNO3S
Chemical Name:
4-bromo-2-tert-butyl-1,1-dioxo-1,2-thiazol-3-one
Synonyms:
4-Bromo-2-tert-butyl-1,1-dioxo-1,2-dihydroisothiazol-3-one;

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4-bromo-2-tert-butyl-1,1-dioxo-1,2-thiazol-3-one Basic Attributes

Molecular Weight：

268.12800

Exact Mass：

266.95648

DSSTox ID：

DTXSID70598000

HScode：

2934100090

Characteristics

PSA：

62.83000

XLogP3：

2.21190

Density：

1.732g/cm3

Boiling Point：

313.8ºC

Flash Point：

143.6ºC

Refractive Index：

1.595

Vapor Pressure：

0.000486mmHg at 25°C

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:268.13
XLogP3:1.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:266.95648
Monoisotopic Mass:266.95648
Topological Polar Surface Area:62.8
Heavy Atom Count:13
Complexity:372
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-bromo-2-tert-butyl-1,1-dioxo-1,2-thiazol-3-one

Basic Attributes
Characteristics
Safety Information
Computed Properties

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