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Home > Encyclopedia > 1,3-Benzodioxole-5-propanoic acid

1,3-Benzodioxole-5-propanoic acid

1,3-Benzodioxole-5-propanoic acid structure

1,3-Benzodioxole-5-propanoic acid 

structure
  • CAS No:

    2815-95-4

  • Formula:

    C10H10O4

  • Chemical Name:

    1,3-Benzodioxole-5-propanoic acid

  • Synonyms:

    1,3-Benzodioxole-5-propanoic acid;Hydrocinnamic acid,3,4-(methylenedioxy)-;3-(3,4-Methylenedioxyphenyl)propionic acid;3,4-(Methylenedioxy)hydrocinnamic acid;1,3-Benzodioxole-5-propionic acid;NSC 55524;3,4-Methylenedioxydihydrocinnamic acid;3-[Benzo[1,3]dioxol-5-yl]propionic acid;3-(Benzodioxol-5-yl)propionic acid;3-(Benzo[d][1,3]dioxol-5-yl)propanoic acid;3-(1,3-Benzodioxol-5-yl)propanoic acid;3-(1,3-Dioxaindan-5-yl)propanoic acid

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

Grey Solid

1,3-Benzodioxole-5-propanoic acid Basic Attributes

194.18

194.18

220-565-9

QWY6P3S6L1

55524

DTXSID10182422

29329990

Characteristics

55.8

1.6

1.343 g/cm3

81-85 °C

141.8ºC

Safety Information

NONH for all modes of transport

2

R36/37/38

S26-S36/37/39

MW5600000

Xn

P261-P305 + P351 + P338

H302-H315-H319-H335

|Warning|H302 (88.37%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, 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.

1,3-Benzodioxole-5-propanoic acid Use and Manufacturing

Substituted cinnamic and dihydrocinnamic acids show anti-inflammatory and analgesic activity, with cinnamic acids being more biologically active.

Computed Properties

Molecular Weight:194.18
XLogP3:1.6
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:55.8
Heavy Atom Count:14
Complexity:216
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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