4-Cyano-L-phenylalaine hydrochloride - ≥98% , CAS No.104531-20-6

CAS: 104531-20-6 Cat. No.: C353025 Molecular Weight: 226.66
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
(S)-2-Amino-3-(4-cyanophenyl)propanoic acid hydrochloride
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
C353025-1g
3
$51.90
5g
C353025-5g
3
$232.90
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C Ships Ice chest + Ice pads 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
(S)-2-Amino-3-(4-cyanophenyl)propanoic acid hydrochloride
Specifications & Purity
≥98%
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥98%
Names and Identifiers
Pubchem Sid504771914
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504771914
Canonical SmilesC1=CC(=CC=C1CC(C(=O)O)N)C#N.Cl
IUPAC Name(2S)-2-amino-3-(4-cyanophenyl)propanoic acid;hydrochloride
InChIKeyXFSNISFWRBJSBI-FVGYRXGTSA-N
INCHI1S/C10H10N2O2.ClH/c11-6-8-3-1-7(2-4-8)5-9(12)10(13)14;/h1-4,9H,5,12H2,(H,13,14);1H/t9-;/m0./s1
Isomeric SMILES C1=CC(=CC=C1C[C@@H](C(=O)O)N)C#N.Cl
Molecular Weight 226.66
Reaxy-Rn 5778401
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5778401&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.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

3D Structure
Interactive Chemical Structure Model





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.

2 results found

Lot NumberCertificate TypeDateItem
H2206599Certificate of AnalysisMay 12, 2025 C353025
H2206600Certificate of AnalysisMay 12, 2025 C353025
Chemical and Physical Properties
Refractive Indexn20D1.60
Specific Rotation[α]α20/D -15.0°±1°, c = 1 in water
Boil Point(°C)394.1° C at 760 mmHg
Melt Point(°C)243° C
Molecular Weight226.660 g/mol
XLogP3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass226.051 Da
Monoisotopic Mass226.051 Da
Topological Polar Surface Area87.100 Ų
Heavy Atom Count15
Formal Charge0
Complexity248.000
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count2
Documents & Articles
Solution Calculators
Reviews

Customer Reviews

Shall we send you a message when we have discounts available?

Remind me later

Thank you! Please check your email inbox to confirm.

Oops! Notifications are disabled.