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Home> Hot Product Listed O   > OPREA1_064451
7632-00-0 structure

OPREA1_064451

Iupac Name:sodium;nitrite
CAS No.:7632-00-0
Molecular Weight:68.995
Molecular Formula:C22H23N3O4 (isomer)
Names and Identifiers
Synonyms

(4-benzhydrylpiperazin-1-yl)-(4-chloro-3-nitrophenyl)methanone (4-chloro-3-nitrophenyl)[4-(diphenylmethyl)piperazin-1-yl]methanone 1-(4-chloro-3-nitrobenzoyl)-4-(diphenylmethyl)piperazine 4-(diphenylmethyl)piperazinyl 4-chloro-3-nitrophenyl ketone AC1LOSBR AKOS000386333 MCULE-2804562305 MOLPORT-001-492-719 ST024679 STK402120 Z27755738 ZINC19759881

Inchi
InChI=1S/HNO2.Na/c2-1-3;/h(H,2,3);/q;+1/p-1
InChkey
LPXPTNMVRIOKMN-UHFFFAOYSA-M
Canonical Smiles
N(=O)[O-].[Na+]
Properties
Melting Point
271℃
HS Code
28341000
Safety and Handling
Risk Statements
R25;R50;R8
Safety Statements
S45;S61
HazardClass
5.1
Hazard Note
H272; H301; H319; H400
PackingGroup
III
Transport
UN 3219
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 >
INTERMEDIATE INDIVIDUAL INTERMEDIATE_USE_ONLY view >
INTERMEDIATE INDIVIDUAL INTERMEDIATE_USE_ONLY view >
Registered companies:
Registrant / Supplier details Latest dossier received
BASF SE 2016
Brenntag UK Ltd 2013
Cambridge Environmental Assessments part of RSK ADAS Ltd 2015
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Oxidizing solids, Category 3

Acute toxicity - Oral, Category 3

Hazardous to the aquatic environment, short-term (Acute) - Category Acute 1

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H272 May intensify fire; oxidizer

H301 Toxic if swallowed

H400 Very toxic to aquatic life

Precautionary statement(s)
Prevention

P210 Keep away from heat, hot surfaces, sparks, open flames and other ignition sources. No smoking.

P220 Keep away from clothing and other combustible materials.

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

P264 Wash ... thoroughly after handling.

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

P273 Avoid release to the environment.

Response

P370+P378 In case of fire: Use ... to extinguish.

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

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

P330 Rinse mouth.

P391 Collect spillage.

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:68.995g/mol
  • Molecular Formula:C22H23N3O4
  • Compound Is Canonicalized:True
  • Exact Mass:68.983
  • Monoisotopic Mass:68.983
  • Complexity:13.5
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:52.5A^2
  • Heavy Atom Count:4
  • 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:2
  • CACTVS Substructure Key Fingerprint: AAADcQACMCAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAAAAAAAAAAAAAQAAB AAAAAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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