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Home > Encyclopedia > Butanoic acid, 1H-indol-3-yl ester

Butanoic acid, 1H-indol-3-yl ester

Butanoic acid, 1H-indol-3-yl ester structure

Butanoic acid, 1H-indol-3-yl ester 

structure
  • CAS No:

    4346-15-0

  • Formula:

    C12H13NO2

  • Chemical Name:

    Butanoic acid, 1H-indol-3-yl ester

  • Synonyms:

    Butanoic acid,1H-indol-3-yl ester;Butyric acid,indol-3-yl ester;Indol-3-ol,butyrate (ester);Indol-3-ol,butyrate;Indoxyl butyrate;Indoxyl n-butyrate;1H-Indol-3-yl butyrate;3-Butyryloxyindole

Description

Pale beige crystals

Butanoic acid, 1H-indol-3-yl ester Basic Attributes

203.23700

203.24

224-404-3

DTXSID70195856

2933990090

Characteristics

42.09000

2.87340

Pale beige crystals

1.178 g/cm3

86-87 °C

360.1ºC at 760 mmHg

171.6ºC

Store at 0ºC

Safety Information

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P403+P233, P405, P501

H315

|Danger|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

indoxyl butyrate

Computed Properties

Molecular Weight:203.24
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:203.094628657
Monoisotopic Mass:203.094628657
Topological Polar Surface Area:42.1
Heavy Atom Count:15
Complexity:230
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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