Ethyl DL-Mandelate - ≥95% , CAS No.774-40-3

CAS: 774-40-3 Cat. No.: E156515 Molecular Weight: 180.2 EC Number: 212-263-0
AVAILABLE TO ORDER
GRADE & PURITY ≥95%
Synonyms
Benzeneacetic acid, a-hydroxy-, ethyl ester | SY017475 | Benzeneacetic acid, alpha-hydroxy-, ethyl ester (9CI) | FT-0604394 | NSC 5307 | 2-10-00-00121 (Beilstein Handbook Reference) | AI3-01643 | Mandelsaeureaethylester [German] | NSC-5307 | DTXCID7031618
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
5g
E156515-5g
3

$9.90

$14.90
Save $5.00 (33.56%)
25g
E156515-25g
4

$28.90

$43.90
Save $15.00 (34.17%)
100g
E156515-100g
3

$95.90

$143.90
Save $48.00 (33.36%)
500g
E156515-500g
1

$396.90

$595.90
Save $199.00 (33.39%)
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🧪

Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
Benzeneacetic acid, a-hydroxy-, ethyl ester | SY017475 | Benzeneacetic acid, alpha-hydroxy-, ethyl ester (9CI) | FT-0604394 | NSC 5307 | 2-10-00-00121 (Beilstein Handbook Reference) | AI3-01643 | Mandelsaeureaethylester [German] | NSC-5307 | DTXCID7031618
Specifications & Purity
≥95%
Storage
Room temperature
Shipped In
Normal
Purity
≥95%
Names and Identifiers
Pubchem Sid488181780
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488181780
Canonical SmilesCCOC(=O)C(C1=CC=CC=C1)O
IUPAC Nameethyl 2-hydroxy-2-phenylacetate
InChIKeySAXHIDRUJXPDOD-UHFFFAOYSA-N
INCHI1S/C10H12O3/c1-2-13-10(12)9(11)8-6-4-3-5-7-8/h3-7,9,11H,2H2,1H3
Isomeric SMILES CCOC(=O)C(C1=CC=CC=C1)O
Alternate CAS 4358-88-7
Molecular Weight 180.2
Reaxy-Rn 975233
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=975233&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentBenzene and substituted derivatives
Alternative Parents Secondary alcohols  Carboxylic acid esters  Monocarboxylic acids and derivatives  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  Aromatic alcohols  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Monocyclic benzene moiety - Secondary alcohol - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic alcohol - Organooxygen compound - Carbonyl group - Alcohol - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
External Descriptors ethyl ester - secondary alcohol
3D Structure
Interactive Chemical Structure Model





Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

8 results found

Lot NumberCertificate TypeDateItem
I1906020Certificate of AnalysisJun 09, 2023 E156515
E2309522Certificate of AnalysisFeb 07, 2023 E156515
E2309526Certificate of AnalysisFeb 07, 2023 E156515
E2309532Certificate of AnalysisFeb 07, 2023 E156515
E2309546Certificate of AnalysisFeb 07, 2023 E156515
E2309906Certificate of AnalysisFeb 07, 2023 E156515
E2309918Certificate of AnalysisFeb 07, 2023 E156515
E2309921Certificate of AnalysisFeb 07, 2023 E156515
Chemical and Physical Properties
SolubilitySoluble in Methanol
Flash Point(°F)>230°F
Flash Point(°C)>110°
Boil Point(°C)133°C/13mmHg
Melt Point(°C)23-27℃
Molecular Weight180.200 g/mol
XLogP31.500
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass180.079 Da
Monoisotopic Mass180.079 Da
Topological Polar Surface Area46.500 Ų
Heavy Atom Count13
Formal Charge0
Complexity162.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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