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Home> Hot Product Listed P   > Phosphonic acid,P,P',P''-[(oxidonitrilo)tris(methylene)]tris-
638-07-3 structure

Phosphonic acid,P,P',P''-[(oxidonitrilo)tris(methylene)]tris-

Iupac Name:ethyl 4-chloro-3-oxobutanoate
CAS No.:638-07-3
Molecular Weight:164.585
Molecular Formula:C22H28O6 (isomer)
Names and Identifiers
Synonyms

Nitrilotris(methylenephosphonic acid)N-oxide Phosphonic acid,[nitrilotris(methylene)]tri-, N-oxide (8CI) Phosphonic acid,[nitrilotris(methylene)]tris-, N-oxide Phosphonicacid, [(oxidonitrilo)tris(methylene)]tris- (9CI) Tris(phosphonomethyl)amine N-oxide

Inchi
InChI=1S/C6H9ClO3/c1-2-10-6(9)3-5(8)4-7/h2-4H2,1H3
InChkey
OHLRLMWUFVDREV-UHFFFAOYSA-N
Canonical Smiles
CCOC(=O)CC(=O)CCl
Properties
Density
1.511
Melting Point
-8℃
Boiling Point
365°C at 760 mmHg
Refractive Index
1.451-1.453
Flash Point
201.3°C
HS Code
29183000
Safety and Handling
Risk Statements
R24/25;R34;R51/53
Safety Statements
S26;S36/37/39;S45;S61
HazardClass
8
PackingGroup
II
Transport
UN 2922
Reach Info
This substance has been officially registered by enterprises.
ECHA (EU chemicals Management Agency) published the completed registration file as follows:
Completed registration file:
Registered as ubmitted Total tonnage band  
INTERMEDIATE JOINT INTERMEDIATE_USE_ONLY view >
Registered companies:
Registrant / Supplier details Latest dossier received
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MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 3

Skin corrosion, Category 1B

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H301 Toxic if swallowed

H314 Causes severe skin burns and eye damage

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

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

P260 Do not breathe dust/fume/gas/mist/vapours/spray.

P280 Wear protective gloves/protective clothing/eye protection/face protection.

Response

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

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

P330 Rinse mouth.

P301+P330+P331 IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.

P303+P361+P353 IF ON SKIN (or hair): Take off immediately all contaminated clothing. Rinse skin with water [or shower].

P363 Wash contaminated clothing before reuse.

P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing.

P310 Immediately call a POISON CENTER/doctor/\u2026

P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

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:164.585g/mol
  • Molecular Formula:C22H28O6
  • Compound Is Canonicalized:True
  • XLogP3-AA:0.9
  • Exact Mass:164.024
  • Monoisotopic Mass:164.024
  • Complexity:133
  • Rotatable Bond Count:5
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:43.4A^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: AAADccBgMAAEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgIAAAAACAeggEICCAAABAAI AICQCAAAAAAAAAAAAAEAAgBAABQJAAACAAAEIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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Recommended Suppliers
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:+86-0592-5567629
  • Fax:+86-0592-5567629
  • Tel:86-571-85829152
  • Fax:86-571-85829153
  • Tel:86-25-83697070
  • Fax:86-25-83453275
  • Tel:86-571-87396430
  • Fax:86-571-87396431
  • Tel:86-21-54703619
  • Fax:86-21-54703699
  • Tel:86-188-74586545
  • Fax:86-27-83214668
  • Tel:86-1732-7098554
  • Fax:86-1732-7098554
  • Tel:0086-531-58773055
  • Fax:0086-531-58773066
  • Tel:86-27-87465837
  • Fax:86-27-87772287
 
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