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Home> Hot Product Listed T   > T6628100
58-86-6 structure

T6628100

CAS No.:58-86-6
Molecular Weight:150.1299
Molecular Formula:C21H21N5O (isomer)
Names and Identifiers
Synonyms

MCULE-2532557196 MOLPORT-009-156-899 n-(2-methyl-1-phenylpropyl)-4-[(1h-1,2,4-triazol-1-yl)methyl]benzamide Z228160620

Inchi
InChI=1/C5H10O5/c6-2-1-10-5(9)4(8)3(2)7/h2-9H,1H2/t2-,3+,4-,5+/m1/s1
Canonical Smiles
C1C(C(C(C(O1)O)O)O)O
Properties
Melting Point
90.5℃
Safety and Handling
Risk Statements
36/37/38
Safety Statements
S22;S24/25
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 1000_10000 view >
INTERMEDIATE INDIVIDUAL INTERMEDIATE_USE_ONLY view >
Registered companies:
Registrant / Supplier details Latest dossier received
Danisco Austria GmbH 2013
DHW Deutsche Hydrierwerke GmbH Rodleben 2013
Lenzing AG 2010
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Not classified.

2.2 GHS label elements, including precautionary statements

Pictogram(s) No symbol.
Signal word

No signal word.

Hazard statement(s)

none

Precautionary statement(s)
Prevention

none

Response

none

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:150.1299g/mol
  • Molecular Formula:C21H21N5O
  • Exact Mass:150.052823
  • Monoisotopic Mass:150.052823
  • Complexity:117
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:4
  • Hydrogen Bond Acceptor Count:5
  • Topological Polar Surface Area:90.2
  • Heavy Atom Count:10
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:4
  • 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:86-22-58951207
  • Fax:86-22-58951207
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:+86-0592-5567629
  • Fax:+86-0592-5567629
  • Tel:86-27-13667132959
  • Fax:86-27-13667132919
  • Tel:86-25-83697070
  • Fax:86-25-83453275
  • Tel:86-571-87396430
  • Fax:86-571-87396431
  • Tel:86-27-83214668
  • Fax:86-27-83214668
  • Tel:+86-025-58535435
  • Fax:
  • Tel:86-28-85249238
  • Fax:86-28-85377358
  • Tel:86-27-87465837
  • Fax:86-27-87772287
 
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