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Home> Hot Product Listed A   > A3597/0152425
98-16-8 structure

A3597/0152425

CAS No.:98-16-8
Molecular Weight:161.12445
Molecular Formula:C17H12CLNO3 (isomer)
Names and Identifiers
Synonyms

2-methyl-5-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)-n-(2-morpholin-4-ylethyl)benzenesulfonamide 2-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)-n-(2-morpholin-4-ylethyl)benzenesulfonamide 2-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)-n-[2-(morpholin-4-yl)ethyl]benzenesulfonamide 2-methyl-5-{6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl}-n-[2-(morpholin-4-yl)ethyl]benzenesulfonamide AC1LTCWV AKOS001690037 CCG-25449 MCULE-9280487507 MOLPORT-002-603-317 STK777789 STOCK4S-19709 ZINC19858621

Inchi
InChI=1/C7H6F3N/c8-7(9,10)5-2-1-3-6(11)4-5/h1-4H,11H2
InChkey
VIUDTWATMPPKEL-UHFFFAOYSA-N
Properties
Melting Point
5-6℃
Refractive Index
1.479-1.481
HS Code
29214300
Safety and Handling
Risk Statements
R21/22;R23;R33;R36/37/38
Safety Statements
S26;S28;S36/37/39;S45
HazardClass
6.1
PackingGroup
II
Transport
UN 2948
Reach Info
This substance has been officially registered by enterprises.
ECHA (EU chemicals Management Agency) published the completed registration file as follows:
Completed registration file:
Registered as ubmitted Total tonnage band  
INTERMEDIATE JOINT INTERMEDIATE_USE_ONLY view >
INTERMEDIATE INDIVIDUAL INTERMEDIATE_USE_ONLY view >
Registered companies:
Registrant / Supplier details Latest dossier received
Blue Frog Scientific Limited 2011
CHEMICAL INSPECTION & REGULATION SERVICE LIMITED 2014
Lanxess Deutschland GmbH 2013
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 4

Skin irritation, Category 2

Serious eye damage, Category 1

Hazardous to the aquatic environment, long-term (Chronic) - Category Chronic 2

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H302 Harmful if swallowed

H315 Causes skin irritation

H318 Causes serious eye damage

H411 Toxic to aquatic life with long lasting effects

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

P270 Do not eat, drink or smoke when using this product.

P280 Wear protective gloves/protective clothing/eye protection/face protection.

P273 Avoid release to the environment.

Response

P301+P312 IF SWALLOWED: Call a POISON CENTER/doctor/\u2026if you feel unwell.

P330 Rinse mouth.

P302+P352 IF ON SKIN: Wash with plenty of water/...

P321 Specific treatment (see ... on this label).

P332+P313 If skin irritation occurs: Get medical advice/attention.

P362+P364 Take off contaminated clothing and wash it before reuse.

P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

P310 Immediately call a POISON CENTER/doctor/\u2026

P391 Collect spillage.

Storage

none

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:161.12445g/mol
  • Molecular Formula:C17H12CLNO3
  • XLogP3-AA:2.3
  • Exact Mass:161.045234
  • Monoisotopic Mass:161.045234
  • Complexity:132
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:26
  • Heavy Atom Count:11
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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Recommended Suppliers
  • Tel:+86-25-83208295
  • Fax:+86-25-83208202
  • Tel:0086-27-59207850
  • Fax:0086-27-59524646
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:86-571-85829152
  • Fax:86-571-85829153
  • Tel:86-25-83697070
  • Fax:86-25-83453275
  • Tel:86-571-87396430
  • Fax:86-571-87396431
  • Tel:86-188-74586545
  • Fax:86-27-83214668
  • Tel:86-27-87465837
  • Fax:86-27-87772287
  • Tel:0086-531-58773055
  • Fax:0086-531-58773066
  • Tel:86-21-61723543
  • Fax:86-21-33250189
 
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