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Carbanilic acid, p-tolyl ester structure
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Carbanilic acid, p-tolyl ester

TL;DR: Carbanilic acid, p-tolyl ester (CAS 16323-13-0) is a chemical compound with molecular formula C14H13NO2 and molecular weight 227.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(4-methylphenyl) N-phenylcarbamate

Also Known As: 4-methylphenyl N-phenylcarbamate, CARBANILIC ACID, P-TOLYL ESTER, CRESYL CARBANILATE, P-, (4-methylphenyl) N-phenylcarbamate, 4-Methylphenyl phenylcarbamate

CAS Number
16323-13-0
Molecular Formula
C14H13NO2
Molecular Weight
227.09464 g/mol
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Application Areas

Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (13 patents) Organic Building Blocks (20 patents) Pharmaceutical Intermediates (22 patents)

Technical Specifications

Molecular FormulaC14H13NO2
Molecular Weight227.09464 g/mol
XLogP3.7
Topological Polar Surface Area (TPSA)38.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds3
Exact Mass227.09464 Da
Heavy Atoms17
Complexity241.0
Solubility17.8 [ug/mL] (The mean of the results at pH 7.4)
SMILESCC1=CC=C(C=C1)OC(=O)NC2=CC=CC=C2
InChIKeyPHGYDISVSYRXHT-UHFFFAOYSA-N

Chemical Property Profile of Carbanilic acid, p-tolyl ester

XLogP
3.7
TPSA (Topological Polar Surface Area)
38.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
3
Heavy Atoms
17
Complexity
241.0
Exact Mass
227.09464
Monoisotopic Mass
227.09464
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 Carbanilic acid, p-tolyl ester

The XLogP value of 3.7 indicates that Carbanilic acid, p-tolyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Carbanilic acid, p-tolyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbanilic acid, p-tolyl ester has 1 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 Carbanilic acid, p-tolyl ester?

The CAS number of Carbanilic acid, p-tolyl ester is 16323-13-0.

What is the molecular formula of Carbanilic acid, p-tolyl ester?

The molecular formula of Carbanilic acid, p-tolyl ester is C14H13NO2.

What is the molecular weight of Carbanilic acid, p-tolyl ester?

The molecular weight of Carbanilic acid, p-tolyl ester is 227.09464 g/mol.

Where can I buy Carbanilic acid, p-tolyl ester?

You can request a quote for Carbanilic acid, p-tolyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Carbanilic acid, p-tolyl ester?

Yes, CoreyChem provides custom synthesis services for Carbanilic acid, p-tolyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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