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Home> Hot Product Listed O   > Oxazole, 2-cyclopropyl-4,5-dimethyl-, 3-oxide (9CI)
548-62-9 structure

Oxazole, 2-cyclopropyl-4,5-dimethyl-, 3-oxide (9CI)

CAS No.:548-62-9
Molecular Weight:407.9788
Molecular Formula:C8H10O2S2 (isomer)
Names and Identifiers
Synonyms

Inchi
InChI=1/C25H30N3.ClH/c1-26(2)22-13-7-19(8-14-22)25(20-9-15-23(16-10-20)27(3)4)21-11-17-24(18-12-21)28(5)6;/h7-18H,1-6H3;1H/q+1;/p-1
Canonical Smiles
CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.[Cl-]
Properties
Melting Point
215℃
HS Code
32041300
Safety and Handling
Risk Statements
R22;R41;R45;R50/53
Safety Statements
S45;S53;S60;S61
HazardClass
9
PackingGroup
III
Transport
UN 3077
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
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MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:407.9788g/mol
  • Molecular Formula:C8H10O2S2
  • Exact Mass:407.212826
  • Monoisotopic Mass:407.212826
  • Complexity:542
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:9.5
  • Heavy Atom Count:29
  • 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:2
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Recommended Suppliers
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