Cas no 20698-91-3 (Methyl (R)-(-)-Mandelate)

Methyl (R)-(-)-Mandelate structure
Methyl (R)-(-)-Mandelate structure
Product Name:Methyl (R)-(-)-Mandelate
CAS No:20698-91-3
MF:C9H10O3
MW:166.173902988434
MDL:MFCD00064247
CID:51619
PubChem ID:2724623
Update Time:2025-04-18

Methyl (R)-(-)-Mandelate Chemical and Physical Properties

Names and Identifiers

    • (R)-(-)-Methyl mandelate
    • (-)-Methyl (R)-alpha-hydroxyphenylacetate
    • Methyl D-(-)-Mandelate
    • Methyl R-(-)-mandelate
    • D-(-)-Mandelic Acid Methyl Ester
    • METHYL (R)-(-)-MANDELATE
    • (-)-Methyl D-mandelate
    • (R)-2-hydroxy-2-phenylacetic acid methyl ester
    • (R)-mandelic acid methyl ester
    • AC1MC5BK
    • methyl (R)-(-)-2-hydroxy-2-phenylacetate
    • methyl (R)-mandelate
    • PubChem10418
    • SureCN186900
    • (R)-Methyl 2-hydroxy-2-phenylacetate
    • (r)-methyl mandelate
    • methyl (2R)-2-hydroxy-2-phenylacetate
    • ITATYELQCJRCCK-MRVPVSSYSA-N
    • (R)-(-)-Mandelic acid methyl ester
    • (R)-(-)-alpha-Hydroxyphenylacetic acid methyl ester
    • Methyl hydroxy(phenyl)acetate #
    • (-)-D-Mandelic acid methyl ester
    • D-Mandelic acid methyl
    • Methyl (R)-(-)-Mandelate
    • MDL: MFCD00064247
    • Inchi: 1S/C9H10O3/c1-12-9(11)8(10)7-5-3-2-4-6-7/h2-6,8,10H,1H3/t8-/m1/s1
    • InChI Key: ITATYELQCJRCCK-MRVPVSSYSA-N
    • SMILES: O[C@@H](C(=O)OC)C1C=CC=CC=1
    • BRN: 3589447

Computed Properties

  • Exact Mass: 166.063
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 150
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 1.2
  • Topological Polar Surface Area: 46.5

Experimental Properties

  • Color/Form: White powder
  • Density: 1.1097 (rough estimate)
  • Melting Point: 56-58?°C (lit.)
  • Boiling Point: 258.1℃ at 760 mmHg
  • Flash Point: >110℃
  • Refractive Index: 1.4371 (estimate)
  • PSA: 46.53
  • Specific Rotation: -146 o (c=2, MeOH)
  • Optical Activity: [α]20/D ?144.0°, c =?1 in methanol
  • Solubility: Not determined

Methyl (R)-(-)-Mandelate Security Information

  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Safety Instruction: S22;S24/25
  • Safety Term:S22;S24/25

Methyl (R)-(-)-Mandelate Pricemore >>

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Methyl (R)-(-)-Mandelate Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:20698-91-3)Methyl (R)-(-)-Mandelate
Order Number:A814822
Stock Status:in Stock
Quantity:500g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 05:02
Price ($):305.0
Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:20698-91-3)(R)-(-)-扁桃酸甲酯
Order Number:LE26567218
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:56
Price ($):discuss personally

Methyl (R)-(-)-Mandelate Related Literature

Recommended suppliers
Amadis Chemical Company Limited
(CAS:20698-91-3)Methyl (R)-(-)-Mandelate
A814822
Purity:99%
Quantity:500g
Price ($):305.0
Email
Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:20698-91-3)(R)-(-)-扁桃酸甲酯
LE26567218
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
Email