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Home> Hot Product Listed T   > Thiocyanic acid,2-(2-butoxyethoxy)ethyl ester
24888-93-5 structure

Thiocyanic acid,2-(2-butoxyethoxy)ethyl ester

Iupac Name:6-methyl-2-methylsulfanylpyrimidin-4-amine
CAS No.:24888-93-5
Molecular Weight:155.219
Molecular Formula:TM+3 (isomer)
Names and Identifiers
Synonyms

.beta.-butoxy-.beta.'-thiocyanodiethyl ether 1-(2-(2-thiocyanatoethoxy)ethoxy)butane 1-butoxy-.alpha.-(2-thiocyanoethoxy)ethane 1-butoxy-2-(2-thiocyanoethoxy)ethane 1-butoxy-2-[2-(cyanosulfanyl)ethoxy]ethane 1-butoxy-alpha-(2-thiocyanoethoxy)ethane 2-(2-(butoxy)ethoxy) ester of thiocyanic acid 2-(2-(butoxy)ethoxy)ethyl thiocyanic acid ester 2-(2-butoxyethoxy)ethyl ester of thiocyanic acid 2-(2-butoxyethoxy)ethyl thiocyanate 2-(2-butoxyethoxy)-ethyl thiocyanate 2-(2-butoxyethoxy)ethylthiocyanate 2-(2-butoxyethoxy)ethylthiokyanat 2-(2-butoxyethoxy)ethylthiokyanat [czech] 2-[2-(butoxy)ethoxy]ethyl thiocyanic acid ester 2-[2-butoxyethoxy]ethyl thiocyanate 2-butoxy-2'-thiocyanodiethyl ether 3,6-Dioxadecyl thiocyanate AC1L1QHD AC1Q2XKS ai3-00006 AKOS024332353 beta-butoxy beta'-thiocyano diethyl ether beta-butoxy-beta'-thiocyano diethyl ether beta-butoxy-beta'-thiocyanodiethyl ether brn 1812307 butoxyrhodanodiethyl ether butyl carbitol rhodanate butyl carbitol thiocyanate Butyl carbitolrhodanate c-55532 caswell no. 084 ccris 5986 CHEMBL1867205 CJ-26995 CTK4A7867 DTXSID6024674 einecs 203-985-7 ent 6 epa pesticide chemical code 010002 ethane, 1-butoxy-2-(2-thiocyanatoethoxy)- ethanol, 2-(2-butoxyethoxy)-, thiocyanate ethanol, thiocyanate hsdb 1517 JVGPVVUTUMQJKL-UHFFFAOYSA-N lethane lethane 384 lethane 384 regular lethane 384 special (use 2 code nos. 010002 and 010101) LS-556 MCULE-4470701172 NCGC00091820-01 NCGC00091820-02 NCGC00257458-01 NCGC00258869-01 nsc 3534 nsc3534 nsc-3534 SCHEMBL434543 thiocyanic acid, 2-(2-butoxyethoxy)ethyl ester tox21_201317 wln: ncs2o2o4 Z8ANL9B54I ZINC1666829

Inchi
InChI=1S/C6H9N3S/c1-4-3-5(7)9-6(8-4)10-2/h3H,1-2H3,(H2,7,8,9)
InChkey
VSWNFVWHRRUHMM-UHFFFAOYSA-N
Canonical Smiles
CC1=CC(=NC(=N1)SC)N
Properties
Density
1.617
Vapour
0.000274mmHg at 25°C
Refractive Index
1.604
Solubility
PRACTICALLY INSOL IN WATER; MISCIBLE WITH HYDROCARBONS & MOST ORGANIC SOLVENTS
SOL IN PETROLEUM OILS
Color/Form
LIQUID
Clear brown oil
Other physical and chemical properties
PHYSICAL DESCRIPTION: Brownish oil or clear yellow liquid. (NTP, 1992)
Stability
STABLE AT ORDINARY TEMPERATURES BUT TENDS TO REARRANGE AT HIGHER TEMPERATURES
Spectral properties
INDEX OF REFRACTION: 1.4657 @ 20 DEG C/D
Intense mass spectral peaks: 57 m/z (100%), 41 m/z (71%), 45 m/z (39%), 60 m/z (25%)
Safety and Handling
Safety
A poison by ingestion, skin contact, intraperitoneal, subcutaneous, and intravenous routes. Moderately toxic by an unspecified route. High concentrations can cause central nervous system depression. An insecticide. See also THIOCYANATES, ESTERS, and ETHERS. When heated to decomposition it emits very toxic fumes of SOx, NOx, and CN−.
Formulations/Preparations
LETHANE IS TRADE NAME OF SYNTHETIC ALIPHATIC THIOCYANATE CONCENTRATES AND IS MARKETED BY ROHM AND HAAS (PHILADELPHIA, PA) AS LETHANE 384, LETHANE 384 SPECIAL, AND LETHANE 60.
LETHANE 384: 50% BY VOL SOLN IN KEROSENE.
COMMERCIAL PRODUCT ... IS MIXTURE WITH PETROLEUM DISTILLATE WHICH CONSTITUTES 47% BY WT OR 50% BY VOL.
LETHANE* 384 SPECIAL (DISCONTINUED) ... CONTAINED BETA-BUTOXY-BETA'-THIOCYANODIETHYL ETHER & BETA-THIOCYANOETHYL ESTERS OF ALIPHATIC ACIDS IN A PETROLEUM DISTILLATE.
53% SOLUTION /LETHANE* 384 REGULAR/
Specification

Safety Statements:13-36/37-45
13:Keep away from food, drink and animal feeding stuffs
36/37:Wear suitable protective clothing and gloves
45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible)
Computational chemical data
  • Molecular Weight:155.219g/mol
  • Molecular Formula:TM+3
  • Compound Is Canonicalized:True
  • Exact Mass:155.052
  • Monoisotopic Mass:155.052
  • Complexity:109
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:77.1A^2
  • Heavy Atom Count:10
  • 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: AAADccBjAABAAAAAAAAAAAAAAAAAAAAAAAAsAAAAAAAAAAABgAAAHAQQAAAACAiBFgCzsJZIEAig ASZiZACA0ClhAqABGCAwZBiAKABAycAEBAhIEAJAQCAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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Recommended Suppliers
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:86-571-87396430
  • Fax:86-571-87396431
  • 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:+86-021-51093016
  • Fax:+86-021-51062076
  • Tel:+86-021-51093016
  • Fax:+86-021-51062076
 
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