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Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)- structure
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Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)-

TL;DR: Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)- (CAS 39878-87-0) is a chemical compound with molecular formula C8H9Cl2NO and molecular weight 205.00612 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-amino-2-phenylacetyl chloride;hydrochloride

Also Known As: D(-)-PHENYLGLYCINEHCL, (R)-(-)-2-Phenylglycine chloride hydrochloride, 2-amino-2-phenylacetyl chloride hydrochloride, (2-Chloro-2-oxo-1-phenylethyl)ammonium chloride, (R)-2-Amino-2-phenylacetyl chloride hydrochloride

CAS Number
39878-87-0
Molecular Formula
C8H9Cl2NO
Molecular Weight
205.00612 g/mol
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Application Areas

Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (1 patents) Heterocyclic Building Blocks (48 patents) Organic Building Blocks (1 patents) Pharmaceutical Intermediates (5 patents)

Technical Specifications

Molecular FormulaC8H9Cl2NO
Molecular Weight205.00612 g/mol
XLogP1.87
Topological Polar Surface Area (TPSA)43.1 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors2
Rotatable Bonds2
Exact Mass205.00612 Da
Heavy Atoms12
Complexity143.0
SMILESC1=CC=C(C=C1)C(C(=O)Cl)N.Cl
InChIKeyGVVFCAFBYHYGEE-UHFFFAOYSA-N

Chemical Property Profile of Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)-

XLogP
1.87
TPSA (Topological Polar Surface Area)
43.1
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
2
Rotatable Bonds
2
Heavy Atoms
12
Complexity
143.0
Exact Mass
205.00612
Monoisotopic Mass
205.00612
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)-

The XLogP value of 1.87 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)-. With a topological polar surface area (TPSA) of 43.1 Ų, Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)-?

The CAS number of Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)- is 39878-87-0.

What is the molecular formula of Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)-?

The molecular formula of Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)- is C8H9Cl2NO.

What is the molecular weight of Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)-?

The molecular weight of Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)- is 205.00612 g/mol.

Where can I buy Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)-?

You can request a quote for Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)-?

Yes, CoreyChem provides custom synthesis services for Benzeneacetyl chloride, alpha-amino-, hydrochloride (1:1), (alphaS)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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