Cas no 13704-09-1 (Ethyl (S)-(+)-mandelate)

Ethyl (S)-(+)-mandelate structure
Ethyl (S)-(+)-mandelate structure
Product Name:Ethyl (S)-(+)-mandelate
CAS No:13704-09-1
MF:C10H12O3
MW:180.200483322144
MDL:MFCD00064249
CID:94621
PubChem ID:87573230
Update Time:2025-04-18

Ethyl (S)-(+)-mandelate Chemical and Physical Properties

Names and Identifiers

    • L-(+)-Mandelic Acid Ethyl Ester
    • Ethyl L-(+)-Mandelate
    • Ethyl (S)-(+)-Mandelate
    • (S)-(-)-ethyl 2-hydroxy-2-phenylacetate
    • (S)-ethylmandelate
    • <small>L<
    • 309974_ALDRICH
    • AC1OCW2S
    • AC1Q31OX
    • AC1Q31OY
    • ethyl (S)-(+)-2-hydroxy-2-phenylacetate
    • L-()-Mandelic Acid Ethyl Ester
    • SureCN4297584
    • (S)-(+)-Ethyl Mandelate
    • (S)-MANDELIC ACID ETHYL ESTER
    • (S)-(+)-MANDELIC ACID ETHYL ESTER
    • (S)-Ethyl 2-hydroxy-2-phenylacetate
    • L-(+)-MANDELIC ACID ETHYL ESTER 98+%
    • Ethyl (S)-(+)-mandelate 99%, optical purity ee: 99% (GLC)
    • SAXHIDRUJXPDOD-VIFPVBQESA-N
    • Ethyl hydroxy(phenyl)acetate #
    • (s)-ethyl mandelate
    • ethyl (2S)-hydroxy(phenyl)acetate
    • 6835AJ
    • ethyl (2S)-2-hydroxy-2-phen
    • 13704-09-1
    • MFCD00064249
    • L-(+)-MANDELICACIDETHYLESTER
    • ethyl (2S)-2-hydroxy-2-phenylacetate
    • CHEBI:78405
    • M1273
    • (S)-Hydroxyphenylacetic acid ethyl ester
    • J-006953
    • AKOS015911873
    • AS-31807
    • CS-0143523
    • Benzeneacetic acid,a-hydroxy-,ethyl ester,(as)-
    • Ethyl (S)-(+)-mandelate, 99%, optical purity ee: 99% (GLC)
    • Q27147808
    • SCHEMBL4297584
    • Ethyl (S)-(+)-mandelate
    • MDL: MFCD00064249
    • Inchi: 1S/C10H12O3/c1-2-13-10(12)9(11)8-6-4-3-5-7-8/h3-7,9,11H,2H2,1H3/t9-/m0/s1
    • InChI Key: SAXHIDRUJXPDOD-VIFPVBQESA-N
    • SMILES: O(CC)C([C@H](C1C=CC=CC=1)O)=O

Computed Properties

  • Exact Mass: 180.07866
  • Monoisotopic Mass: 180.078644241g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 4
  • Complexity: 162
  • 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
  • XLogP3: 1.5
  • Topological Polar Surface Area: 46.5
  • Surface Charge: 0
  • Tautomer Count: nothing

Experimental Properties

  • Color/Form: powder
  • Density: 1.120(lit.)
  • Melting Point: 32-34?°C (lit.)
  • Boiling Point: 107°C/4mmHg(lit.)
  • Flash Point: Degrees Fahrenheit:>235.4°F
    Degrees Celsius:>113°C
  • Refractive Index: 1.5392 (estimate)
  • PSA: 46.53
  • Solubility: Not determined
  • Optical Activity: [α]21/D +134°, c =?3 in chloroform

Ethyl (S)-(+)-mandelate Security Information

  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3

Ethyl (S)-(+)-mandelate Pricemore >>

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Ethyl (S)-(+)-mandelate Suppliers

Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:13704-09-1)S-扁桃酸乙酯
Order Number:LE26567217
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:56
Price ($):discuss personally
Recommended suppliers
Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:13704-09-1)S-扁桃酸乙酯
LE26567217
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
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