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Home > Encyclopedia > (1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl 2,2-dihydroxyacetate

(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl 2,2-dihydroxyacetate

(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl 2,2-dihydroxyacetate structure

(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl 2,2-dihydroxyacetate 

structure
  • CAS No:

    111969-64-3

  • Formula:

    C12H22O4

  • Chemical Name:

    (1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl 2,2-dihydroxyacetate

  • Synonyms:

    Acetic acid,2,2-dihydroxy-,(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester;Acetic acid,dihydroxy-,5-methyl-2-(1-methylethyl)cyclohexyl ester,[1R-(1α,2β,5α)]-;Acetic acid,dihydroxy-,(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester;(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl 2,2-dihydroxyacetate;2,2-Dihydroxyacetic acid,(-)-menthyl ester

  • Categories:

    Active Pharmaceutical Ingredients  >  Other Chemical Drugs

(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl 2,2-dihydroxyacetate Basic Attributes

230.3

230.30

416-810-6

Characteristics

66.8

2.4

1.09

80-81 °C

320°C at 760 mmHg

113°C

1.487

Safety Information

9

3077

9

S61-S36/39-S26-S22

Xn;N

P260, P273, P280, P305+P351+P338, P310, P314, P391, P501

H318

|Danger|H318: Causes serious eye damage [Danger Serious eye damage/eye irritation]|P260, P273, P280, P305+P351+P338, P310, P314, P391, and P501|H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]|Aggregated GHS information provided by 3 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Aggregated GHS information provided by 77 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:230.30
XLogP3:2.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:230.15180918
Monoisotopic Mass:230.15180918
Topological Polar Surface Area:66.8
Heavy Atom Count:16
Complexity:237
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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