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Home> Hot Product Listed P   > Phosphoric acid,4-nitrophenyl dipropyl ester
6419-19-8 structure

Phosphoric acid,4-nitrophenyl dipropyl ester

Iupac Name:[bis(phosphonomethyl)amino]methylphosphonic acid
CAS No.:6419-19-8
EINECS(EC#): 247-083-1
Molecular Weight:299.05000
Molecular Formula:C20H30O6 (isomer)
Names and Identifiers
Synonyms

(4-nitrophenyl) dipropyl phosphate AC1L2F0M bay 55640 bay-55640 brn 1890859 di-n-propyl paraoxon DTXSID40151040 LS-107836 OR205720 paraoxon propyl paraoxon, di-n-propyl phosphoric acid, dipropyl p-nitrophenyl ester Phosphoricacid, p-nitrophenyl dipropyl ester (6CI,7CI,8CI) Propyl paraoxon propyl-e 600 propylparaoxon

Inchi
InChI=1S/C3H12NO9P3/c5-14(6,7)1-4(2-15(8,9)10)3-16(11,12)13/h1-3H2,(H2,5,6,7)(H2,8,9,10)(H2,11,12,13)
InChkey
YDONNITUKPKTIG-UHFFFAOYSA-N
Canonical Smiles
C(N(CP(=O)(O)O)CP(=O)(O)O)P(=O)(O)O
Properties
Melting Point
~215°C (dec.)
Boiling Point
490.1°C at 760 mmHg
Flash Point
85°C
HS Code
2931900090
Safety and Handling
Risk Statements
R34
Safety Statements
S26-S45-S36/37/39-S25
HazardClass
8
PackingGroup
III
Transport
3265
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  
FULL JOINT 10000_100000 view >
Registered companies:
Registrant / Supplier details Latest dossier received
Aquapharm Europe B.V. 2016
CHEMICAL INSPECTION & REGULATION SERVICE LIMITED 2012
CHT R. Beitlich GmbH 2016
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Corrosive to metals, Category 1

Skin irritation, Category 2

Eye irritation, Category 2

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H290 May be corrosive to metals

H315 Causes skin irritation

H319 Causes serious eye irritation

Precautionary statement(s)
Prevention

P234 Keep only in original packaging.

P264 Wash ... thoroughly after handling.

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

Response

P390 Absorb spillage to prevent material damage.

P302+P352 IF ON SKIN: Wash with plenty of water/...

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

P332+P313 If skin irritation occurs: Get medical advice/attention.

P362+P364 Take off contaminated clothing and wash it before reuse.

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

P337+P313 If eye irritation persists: Get medical advice/attention.

Storage

P406 Store in a corrosion resistant/...container with a resistant inner liner.

Disposal

none

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:299.05000g/mol
  • Molecular Formula:C20H30O6
  • Compound Is Canonicalized:True
  • Exact Mass:298.972
  • Monoisotopic Mass:298.972
  • Complexity:305
  • Rotatable Bond Count:6
  • Hydrogen Bond Donor Count:6
  • Hydrogen Bond Acceptor Count:10
  • Topological Polar Surface Area:176A^2
  • Heavy Atom Count:16
  • 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: AAADccBCPAMAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAFAgACCAAAAAAAAQAAAMAABAA QAAAAIAAAAAAAAAAAAAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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