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3,3-Dichloro-2-oxoindoline-5-sulphonyl chloride

HCID 3022352
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Basic information

CAS
93783-15-4
Standard SMILES
O=C1Nc2ccc(S(=O)(=O)Cl)cc2C1(Cl)Cl
InChIKey
XXQVRYBFEWKZBM-UHFFFAOYSA-N
Molecular formula
C8H4Cl3NO3S
Average molar mass
300.5 g/mol
Monoisotopic mass
298.897747

Names & identifiers

Preferred name
3,3-Dichloro-2-oxoindoline-5-sulphonyl chloride
IUPAC
3,3-dichloro-2-oxo-1H-indole-5-sulfonyl chloride
English name
3,3-dichloro-2-oxoindoline-5-sulphonyl chloride
Molecular formula
C8H4Cl3NO3S
Molecular weight
300.55

Names & synonyms

93783-15-43,3-Dichloro-2-oxoindoline-5-sulphonyl chlorideEINECS 298-221-2DTXSID90239640RefChem:485232DTXCID40162131298-221-23,3-dichloro-2-oxoindoline-5-sulfonyl chloride3,3-dichloro-2-oxo-2,3-dihydro-1H-indole-5-sulfonyl chloride3,3-dichloro-2-oxo-1H-indole-5-sulfonyl chlorideMFCD026565213,3-dichloro-2-oxo-indoline-5-sulfonyl chloride
Show more names
3,3-Dichloro-2,3-dihydro-2-oxo-1H-indole-5-sulfonyl chloride2,3-Dihydro-2-oxo-3,3-dichloro-1H-indole-5-sulfonic acid chloride
C8H4Cl3NO3SSCHEMBL6954051SCHEMBL305552191H-Indole-5-sulfonyl chloride, 3,3-dichloro-2,3-dihydro-2-oxo-AKOS001048220SB656885-chlorosulfonyl-3,3-dichloro-2-oxindoleCS-0223815

Database identifiers

CAS
93783-15-4
PubChem CID
3022352
DTXSID
DTXSID90239640
EC Number
298-221-2
Nikkaji
J348.768G

Properties

Computed structural properties

XLogP
2
Topological polar surface area
71.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
16
Formal charge
0
Complexity
417

Physicochemical properties

Symbol(GHS)
5 · GHS05,GHS07
Signal word
Danger
Hazard statements
302 · H302-H335-H314
Precautionary statements
260 · P260-P264-P270-P271-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P403+P233-P405-P501

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS05,GHS07
Hazard statements
H302-H335-H314
Precautionary statements
P260-P264-P270-P271-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P403+P233-P405-P501

Chemistry & industry

Upstream & downstream products

Upstream raw materials

5-(Chlorosulfonyl) IsatinIsatin

Related reactions

2 records
New reaction record
HRID 323711 reaction equation
HRID 323711As reactantuspto-grants-2001_04
HRID 933003 reaction equation
HRID 933003As reactantValidation data from https://doi.org/10.1039/C8SC04228D

Compound notes

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