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Home> Hot Product Listed T   > T6601597
12036-35-0 structure

T6601597

CAS No.:12036-35-0
Molecular Weight:253.8092
Molecular Formula:C22H23CLN4O5S (isomer)
Names and Identifiers
Synonyms

1-{2-[(2-methylcyclohexyl)oxy]ethyl}-3-(2-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}ethyl)urea MCULE-7817198938 MOLPORT-009-553-564 Z434482122

Inchi
InChI=1/3O.2Rh/q3*-2;2*+3
InChkey
XBBXDTCPEWHXKL-UHFFFAOYSA-N
Canonical Smiles
[O-2].[O-2].[O-2].[Rh+3].[Rh+3]
Properties
Melting Point
1100°C (dec.)
HS Code
28259085
Safety and Handling
Risk Statements
R36/38;R8
Safety Statements
S17;S26;S37/39
HazardClass
6.1(b)
PackingGroup
III
Transport
3288
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  
FULL JOINT 10_100 view >
Registered companies:
Registrant / Supplier details Latest dossier received
UMICORE AG & Co. KG 2017
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Oxidizing solids, Category 1

Acute toxicity - Oral, Category 4

Hazardous to the aquatic environment, long-term (Chronic) - Category Chronic 4

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H271 May cause fire or explosion; strong oxidizer

H302 Harmful if swallowed

H413 May cause long lasting harmful effects to aquatic life

Precautionary statement(s)
Prevention

P210 Keep away from heat, hot surfaces, sparks, open flames and other ignition sources. No smoking.

P220 Keep away from clothing and other combustible materials.

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

P283 Wear fire resistant or flame retardant clothing.

P264 Wash ... thoroughly after handling.

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

P273 Avoid release to the environment.

Response

P306+P360 IF ON CLOTHING: Rinse immediately contaminated clothing and skin with plenty of water before removing clothes.

P371+P380+P375 In case of major fire and large quantities: Evacuate area. Fight fire remotely due to the risk of explosion.

P370+P378 In case of fire: Use ... to extinguish.

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

P330 Rinse mouth.

Storage

P420 Store separately.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:253.8092g/mol
  • Molecular Formula:C22H23CLN4O5S
  • Exact Mass:253.795752
  • Monoisotopic Mass:253.795752
  • Complexity:0
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:3
  • Heavy Atom Count:5
  • 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:5
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