Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed 3   > 3-Cyclohexen-1-ol, 3-ethoxy-
66684-58-0 structure

3-Cyclohexen-1-ol, 3-ethoxy-

Iupac Name:1,2,3-trifluoro-5-nitrobenzene
CAS No.:66684-58-0
Molecular Weight:177.082
Molecular Formula:C17H21BRN2O4 (isomer)
Names and Identifiers
Synonyms

Inchi
InChI=1S/C6H2F3NO2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H
InChkey
PTTUMBGORBMNBN-UHFFFAOYSA-N
Canonical Smiles
C1=C(C=C(C(=C1F)F)F)[N+](=O)[O-]
Properties
Refractive Index
1.486
Safety and Handling
Risk Statements
R25
Safety Statements
S45
HazardClass
6.1
PackingGroup
III
Transport
UN 2810
Reach Info
Globally, no enterprise has officially registered the substance REACH.
Other official information: ·ECHA Information Page for CAS: 66684-58-0 EC: 3-Cyclohexen-1-ol, 3-ethoxy- ·ECHA C&L Inventory for CAS: CAS: 66684-58-0 EC: 3-Cyclohexen-1-ol, 3-ethoxy-
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 2

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H300 Fatal if swallowed

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

P270 Do not eat, drink or smoke when using this product.

Response

P301+P310 IF SWALLOWED: Immediately call a POISON CENTER/doctor/\u2026

P321 Specific treatment (see ... on this label).

P330 Rinse mouth.

Storage

P405 Store locked up.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:177.082g/mol
  • Molecular Formula:C17H21BRN2O4
  • Compound Is Canonicalized:True
  • XLogP3-AA:2.2
  • Exact Mass:177.004
  • Monoisotopic Mass:177.004
  • Complexity:172
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:5
  • Topological Polar Surface Area:45.8A^2
  • Heavy Atom Count:12
  • 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: AAADcQBiMYAAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAHQAEAAAACAiBEAgwwIAQQACB ACRCQwCCAAAgAgAgiAAAZIoIICKAkZGAIABggAAIyAcQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
Recommended Suppliers
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:86-571-87396430
  • Fax:86-571-87396431
  • Tel:86-755-33239182
  • Fax:86-755-33233381
  • Tel:86-21-61124658
  • Fax:86-21-61294103
  • Tel:86-27-87465837
  • Fax:86-27-87772287
  • Tel:0086-531-58773055
  • Fax:0086-531-58773066
  • Tel:86-21-61723543
  • Fax:86-21-33250189
  • Tel:86-311-66600578
  • Fax:86-311-66600576
  • Tel:86-571-85586718
  • Fax:86-571-85864795
  • Tel:86-573-85280080
  • Fax:86-573-85285100
Recommended Suppliers
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:86-571-87396430
  • Fax:86-571-87396431
  • Tel:86-755-33239182
  • Fax:86-755-33233381
  • Tel:86-21-61124658
  • Fax:86-21-61294103
  • Tel:86-27-87465837
  • Fax:86-27-87772287
  • Tel:0086-531-58773055
  • Fax:0086-531-58773066
  • Tel:86-21-61723543
  • Fax:86-21-33250189
  • Tel:86-311-66600578
  • Fax:86-311-66600576
  • Tel:86-571-85586718
  • Fax:86-571-85864795
  • Tel:86-573-85280080
  • Fax:86-573-85285100
 
<