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Home > Encyclopedia > Benzoic acid, 5-acetyl-2-hydroxy-, methyl ester

Benzoic acid, 5-acetyl-2-hydroxy-, methyl ester

Benzoic acid, 5-acetyl-2-hydroxy-, methyl ester structure

Benzoic acid, 5-acetyl-2-hydroxy-, methyl ester 

structure
  • CAS No:

    16475-90-4

  • Formula:

    C10H10O4

  • Chemical Name:

    Benzoic acid, 5-acetyl-2-hydroxy-, methyl ester

  • Synonyms:

    Benzoic acid,5-acetyl-2-hydroxy-,methyl ester;Salicylic acid,5-acetyl-,methyl ester;Methyl 5-acetylsalicylate;Methyl 3-acetyl-6-hydroxybenzoate;Methyl 5-acetyl-2-hydroxybenzoate;5-Acetyl-2-hydroxybenzoic acid methyl ester;Methyl 2-hydroxy-5-acetylbenzoate;NSC 67867;5-Acetylsalicylic acid methyl ester

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

white to light yellow-orange crystalline powder

Benzoic acid, 5-acetyl-2-hydroxy-, methyl ester Basic Attributes

194.18

194.18

2643824

240-532-2

5LXG3K3H5F

67867

DTXSID80167807

29189900

Characteristics

63.6

1.38140

white to light yellow-orange crystalline powder

1.0583 (rough estimate)

55 °C

167 °C / 15mmHg

138.0±17.2 °C

1.5168 (estimate)

Soluble in methanol.

Refrigerator

Safety Information

NONH for all modes of transport

3

36/37/38

26-36

Xi

P261-P305 + P351 + P338

H315-H319-H335

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Benzoic acid, 5-acetyl-2-hydroxy-, methyl ester Use and Manufacturing

Used as pharmaceutical intermediate

Computed Properties

Molecular Weight:194.18
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:194.05790880
Monoisotopic Mass:194.05790880
Topological Polar Surface Area:63.6
Heavy Atom Count:14
Complexity:236
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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