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Home> Hot Product Listed M   > MCULE-8072035568
35065-86-2 structure

MCULE-8072035568

Iupac Name:(3-bromophenyl) acetate
CAS No.:35065-86-2
Molecular Weight:215.04398
Molecular Formula:C17H21N3O3S (isomer)
Names and Identifiers
Synonyms

MOLPORT-020-099-900 n-[(5-bromofuran-2-yl)methyl]-2-hydroxy-n,5-dimethylbenzamide Z384377402 ZINC41396175

Inchi
InChI=1S/C8H7BrO2/c1-6(10)11-8-4-2-3-7(9)5-8/h2-5H,1H3
InChkey
CDLTWXBTYNNYLN-UHFFFAOYSA-N
Canonical Smiles
CC(=O)OC1=CC(=CC=C1)Br
Properties
Refractive Index
1.544
Reach Info
Globally, no enterprise has officially registered the substance REACH.
Other official information: ·ECHA Information Page for CAS: 35065-86-2 EC: MCULE-8072035568 ·ECHA C&L Inventory for CAS: CAS: 35065-86-2 EC: MCULE-8072035568
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:215.04398g/mol
  • Molecular Formula:C17H21N3O3S
  • XLogP3-AA:2.4
  • Exact Mass:213.962942
  • Monoisotopic Mass:213.962942
  • Complexity:147
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:26.3
  • 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
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Recommended Suppliers
  • Tel:86-755-33239182
  • Fax:86-755-33233381
  • Tel:86-27-87465837
  • Fax:86-27-87772287
  • Tel:33 2 98 42 46 50
  • Fax:33 2 98 42 44 02
  • Tel:
  • Fax:+86 (515) 8740-0189
  • Tel:+86 519 8630 5871
  • Fax:
  • Tel:86-0574-87406360
  • Fax:
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