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Home> Encyclopedia > Hot Product Listed 5   > 5-Thiazolecarboxylicacid, 2-(ethylamino)-4-methyl-
532-32-1 structure

5-Thiazolecarboxylicacid, 2-(ethylamino)-4-methyl-

Iupac Name:sodium benzoate
CAS No.:532-32-1
EINECS(EC#): 259-485-4
Molecular Weight:144.10317
Molecular Formula:C60H84N2O22 (isomer)
Names and Identifiers
Synonyms

2-(Ethylamino)-4-methyl-1,3-thiazole-5-carboxylic acid 2-(ethylamino)-4-methyl-1,3-thiazole-5-carboxylic acid(SALTDATA: FREE) 2-ETHYLAMINO-4-METHYL-THIAZOLE-5-CARBOXYLIC ACID CHEMBRDG-BB 4010427

Inchi
InChI=1/C7H6O2.Na/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H,8,9);/q;+1/p-1
InChkey
WXMKPNITSTVMEF-UHFFFAOYSA-M
Canonical Smiles
C1=CC=C(C=C1)C(=O)[O-].[Na+]
Isomers Smiles
C1=CC=C(C=C1)C(=O)[O-].[Na+]
Properties
Melting Point
>300 °C(lit.)
Vapour
2.9X10-12 mm Hg at 25 deg C (est)
Flash Point
322.9°C
HS Code
29163100
Safety and Handling
Risk Statements
R36/37/38
Safety Statements
S24/25
Hazard Note
H319
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Eye irritation, Category 2

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H319 Causes serious eye irritation

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

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

Response

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

none

Disposal

none

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:144.10317g/mol
  • Molecular Formula:C60H84N2O22
  • Exact Mass:144.018724
  • Monoisotopic Mass:144.018724
  • Complexity:108
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:40.1
  • 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:2
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  • Tel:+86-311-85355123
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  • Tel:86-571-87396430
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