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Home> Hot Product Listed T   > T6489216
51785-23-0 structure

T6489216

Iupac Name:2-piperidin-2-yl-1H-benzimidazole
CAS No.:51785-23-0
Molecular Weight:201.273
Molecular Formula:C15H18N4O2 (isomer)
Names and Identifiers
Synonyms

2-[(1,3-benzothiazol-2-yl)methoxy]-n-(2,3-dihydro-1h-inden-1-yl)-n-methylacetamide AB01005184-01 MCULE-7347532349 MOLPORT-009-475-400 Z272456828

Inchi
InChI=1S/C12H15N3/c1-2-6-10-9(5-1)14-12(15-10)11-7-3-4-8-13-11/h1-2,5-6,11,13H,3-4,7-8H2,(H,14,15)
InChkey
WADQLYMWCOLMMB-UHFFFAOYSA-N
Canonical Smiles
C1CCNC(C1)C2=NC3=CC=CC=C3N2
Properties
Refractive Index
1.628
Safety and Handling
Safety Statements
Hazard Codes Xi
HazardClass
IRRITANT
Reach Info
Globally, no enterprise has officially registered the substance REACH.
Other official information: ·ECHA Information Page for CAS: 51785-23-0 EC: T6489216 ·ECHA C&L Inventory for CAS: CAS: 51785-23-0 EC: T6489216
Computational chemical data
  • Molecular Weight:201.273g/mol
  • Molecular Formula:C15H18N4O2
  • Compound Is Canonicalized:True
  • Exact Mass:201.127
  • Monoisotopic Mass:201.127
  • Complexity:219
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:40.7A^2
  • Heavy Atom Count:15
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:1
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADccBzAAAAAAAAAAAAAAAAAAAAAWAAAAA8QAAAAAAAAFgB8AAAHAAQAAAACCjBFwQx0LbJkACg ASZiZACCgC2hEqAJmaA4dJiIaKLAmZGUIAhokALIyCcQAAAAAAAAAAAAACAAAAAAAAAAQAAAAAAA AA==
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Recommended Suppliers
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:86-755-33239182
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