Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed T   > T6514810
1182284-47-4 structure

T6514810

Iupac Name:4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazol-2-amine
CAS No.:1182284-47-4
Molecular Weight:168.258
Molecular Formula:C8H9BRO3 (isomer)
Names and Identifiers
Synonyms

1-(1-phenylbutyl)-3-(prop-2-yn-1-yl)urea AB01327688-02 MCULE-8459841304 MOLPORT-009-272-310 Z336513432

Inchi
InChI=1S/C8H12N2S/c1-8(2)4-3-5-6(8)10-7(9)11-5/h3-4H2,1-2H3,(H2,9,10)
InChkey
MARLCVHEFBWNER-UHFFFAOYSA-N
Canonical Smiles
CC1(CCC2=C1N=C(S2)N)C
Computational chemical data
  • Molecular Weight:168.258g/mol
  • Molecular Formula:C8H9BRO3
  • Compound Is Canonicalized:True
  • Exact Mass:168.072
  • Monoisotopic Mass:168.072
  • Complexity:170
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:67.2A^2
  • 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
  • CACTVS Substructure Key Fingerprint: AAADccBzAABAAAAAAAAAAAAAAAAAAeIAAAAAAAAAAAAWAAABgAAAHAQQAAAADgiBVgADkRJIEAik AQRgZAAA8KlhCDkAGBQgQAiAIAJgkACEAAAggAJISCMQAAAPAAAAAAAAAAAAAAAAAAAAAEAAAQCA AA==
Recommended Suppliers
  • Tel:+86-571-85395792
  • Fax:+86-571-85420103
Recommended Suppliers
  • Tel:+86-571-85395792
  • Fax:+86-571-85420103
 
<