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2-chloro-1,1-dioxo-1,2-benzothiazol-3-one

2-chloro-1,1-dioxo-1,2-benzothiazol-3-one structure

CAS No:
14070-51-0
Formula:
C7H4ClNO3S
Chemical Name:
2-chloro-1,1-dioxo-1,2-benzothiazol-3-one
Synonyms:
2-chlorobenzo-1,2-thiazolin-3-one-1,1-dioxide; N-Chlorosaccharin;

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2-chloro-1,1-dioxo-1,2-benzothiazol-3-one Basic Attributes

Molecular Weight：

217.63000

Exact Mass：

216.9600419

UNII：

G35NK0CTFF

DSSTox ID：

DTXSID40404563

HScode：

2934100090

Characteristics

PSA：

62.83000

XLogP3：

2.00360

Density：

1.77g/cm3

Melting Point：

148-152ºC(lit.)

Boiling Point：

388.6ºC at 760mmHg

Flash Point：

188.8ºC

Refractive Index：

1.693

Storage Conditions：

Refrigerator (+4ºC)

Vapor Pressure：

3.02E-06mmHg at 25°C

Safety Information

hazard class code：

R20/21/22; R40

safety instructions：

S22; S26; S36/37/39

Marks：

GHS Classification：

|Warning|H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral]|P201, P202, P261, P264, P270, P271, P280, P281, P301+P312, P302+P352, P304+P312, P304+P340, P308+P313, P312, P322, P330, P363, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:217.63
XLogP3:1.2
Hydrogen Bond Acceptor Count:3
Exact Mass:216.9600419
Monoisotopic Mass:216.9600419
Topological Polar Surface Area:62.8
Heavy Atom Count:13
Complexity:334
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-chloro-1,1-dioxo-1,2-benzothiazol-3-one

Basic Attributes
Characteristics
Safety Information
Computed Properties

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