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Heterocyclic building blocks

CI-624

Also known as 3-(Methylamino)-2,1-benzisothiazole, N-Methyl-2,1-benzisothiazol-3-amine, CI 624

CAS 700-07-2Formula C8H8N2SMolar mass 164.23 g/molEC 173-839-4
GHS signal word: Warning. Pictograms: Harmful or irritant
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CI-624 chemical structure, C8H8N2S, CAS 700-07-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
700-07-2
Formula
C8H8N2S
Molar mass
164.23 g/mol
EC number
173-839-4
HS code
293499
Category
Heterocyclic building blocks

What is CI-624?

Plain description, key identifiers and synonyms

CI-624 is a chemical substance with the molecular formula C8H8N2S and a molar mass of 164.23 g/mol. Its CAS registry number is 700-07-2. The IUPAC name is N-methyl-2,1-benzothiazol-3-amine.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
N-methyl-2,1-benzothiazol-3-amine
CAS number
700-07-2
EC number
173-839-4
Molecular formula
C8H8N2S
UNII
DVJ526480G
InChIKey
ARUJVDNZYGIUGB-UHFFFAOYSA-N
InChI
InChI=1S/C8H8N2S/c1-9-8-6-4-2-3-5-7(6)10-11-8/h2-5,9H,1H3
SMILES (canonical and isomeric)
CNC1=C2C=CC=CC2=NS1

Synonyms

  • 3-(Methylamino)-2,1-benzisothiazole
  • N-Methyl-2,1-benzisothiazol-3-amine
  • CI 624
  • 2,1-Benzisothiazole, 3-(methylamino)-
  • 2,1-Benzisothiazol-3-amine, N-methyl-
  • N-Methylbenzo[c]isothiazol-3-amine
  • N-methyl-2,1-benzothiazol-3-amine

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
164.23 g/molcalc.
Exact mass
164.0408 Dacalc.
LogP (octanol/water)
2.34calc.
Topological polar surface area
24.92 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
1calc.
Heavy atoms
11calc.
Rings
2calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.13calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, c1ccc2nscc2c1

c1ccc2nscc2c1

2 rings, 9 atoms, the Benzo[c]isothiazole ring system.

167 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Warning
GHS07: Harmful or irritant
Harmful or irritant

Hazard statements

  • H302Harmful if swallowed.
  • H312Harmful in contact with skin.
  • H315Causes skin irritation.
  • H319Causes serious eye irritation.
  • H332Harmful if inhaled.
  • H335May cause respiratory irritation.
Precautionary statements (20)
  • P261Avoid breathing dust, fume, gas, mist, vapours or spray.
  • P264Wash skin thoroughly after handling.
  • P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
  • P270Do not eat, drink or smoke when using this product.
  • P271Use only outdoors or in a well-ventilated area.
  • P280Wear protective gloves, protective clothing, eye protection and face protection.
  • P301 + P317If swallowed: Get medical help.
  • P302 + P352If on skin: Wash with plenty of water.
  • P304 + P340If inhaled: Remove person to fresh air and keep comfortable for breathing.
  • P305 + P351 + P338If in eyes: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
  • P317Get medical help.
  • P319Get medical help if you feel unwell.
  • P321Specific treatment (see supplemental first aid instructions on the label).
  • P330Rinse mouth.
  • P332 + P317If skin irritation occurs: Get medical help.
  • P337 + P317If eye irritation persists: Get medical help.
  • P362 + P364Take off contaminated clothing. And wash it before reuse.
  • P403 + P233Store in a well-ventilated place. Keep container tightly closed.
  • P405Store locked up.
  • P501Dispose of contents and container in accordance with local regulations.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Full safety data and first aid

CI-624 suppliers

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CI-624 price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code CI-624 is traded under.

HS 2934.99Indicative HS code

Nucleic acids and their salts, other heterocyclic compounds, not elsewhere classified in heading 2934

World exports in 2024
$26.7B
+15.0% vs 2023, imports $26.3B
2019 to 2024
Top exporters
  1. Ireland26.3%
  2. China15.7%
  3. Singapore10.3%
Top importers
  1. United States24.5%
  2. Germany23.1%
  3. Japan4.5%
Reported customs values in USD, not prices.Full trade data

The HS code shown for CI-624 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about CI-624, based on the data on this page

What is CI-624?

CI-624 is a chemical substance with the molecular formula C8H8N2S and a molar mass of 164.23 g/mol. Its CAS registry number is 700-07-2. The IUPAC name is N-methyl-2,1-benzothiazol-3-amine.

What is the CAS number of CI-624?

The CAS registry number of CI-624 is 700-07-2.

What is the molecular formula and weight of CI-624?

The molecular formula of CI-624 is C8H8N2S and its molar mass is 164.23 g/mol.

What is CI-624 used for?

Known uses and roles of CI-624 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is CI-624 hazardous?

CI-624 carries the GHS signal word "Warning". Main hazards: harmful if swallowed, harmful in contact with skin, causes skin irritation. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of CI-624?

CI-624 is usually classified under HS code 293499 (Nucleic acids and their salts, whether or not chemically defined, other heterocyclic…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy CI-624?

Post a free request on CompoundList and suppliers of CI-624 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of CI-624?

Suppliers quote CI-624 on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle CI-624

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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