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Home > Encyclopedia > α-Ethyl-1-hydroxycyclohexaneacetic acid

α-Ethyl-1-hydroxycyclohexaneacetic acid

α-Ethyl-1-hydroxycyclohexaneacetic acid structure

α-Ethyl-1-hydroxycyclohexaneacetic acid 

structure
  • CAS No:

    512-16-3

  • Formula:

    C10H18O3

  • Chemical Name:

    α-Ethyl-1-hydroxycyclohexaneacetic acid

  • Synonyms:

    Cyclohexaneacetic acid,α-ethyl-1-hydroxy-;α-Ethyl-1-hydroxycyclohexaneacetic acid;JL 130;α-(1-Hydroxycyclohexyl)butyric acid;1-Hydroxy-α-ethylcyclohexylacetic acid;Cyclobutyrol;2-(1-Hydroxycyclohexyl)butanoic acid

Description

ChEBI: A hydroxy monocarboxylic acid in which the hydroxy group is geminal to a 1-carboxypropyl group on a cyclohexane ring.


Cyclobutyrol is a hydroxy monocarboxylic acid in which the hydroxy group is geminal to a 1-carboxypropyl group on a cyclohexane ring. It has a role as a bile therapy drug.

α-Ethyl-1-hydroxycyclohexaneacetic acid Basic Attributes

186.251

186.25

208-138-5

A - Alimentary tract and metabolism

2918199090

Characteristics

57.5

1.79240

1.0010 g/cm3 @ Temp: 15.8 °C

81.5 °C

164 °C @ Press: 24 Torr

170.1ºC

1.508

LD50 oral in rat: 4820mg/kg

Drug Information

alpha-(1-hydroxycyclohexyl)butyric acid

α-Ethyl-1-hydroxycyclohexaneacetic acid Use and Manufacturing

Cyclohexaneacetic acid, .alpha.-ethyl-1-hydroxy-: INACTIVE

Computed Properties

Molecular Weight:186.25
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:186.125594432
Monoisotopic Mass:186.125594432
Topological Polar Surface Area:57.5
Heavy Atom Count:13
Complexity:183
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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