Benzenamine, N-propyl-
TL;DR: Benzenamine, N-propyl- (CAS 622-80-0) is a chemical compound with molecular formula C9H13N and molecular weight 135.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-propylaniline
Also Known As: N-PROPYLANILINE, Benzenamine, N-propyl-, phenylpropylamine, Propylaniline, N-n-Propylaniline
| Molecular Formula | C9H13N |
|---|---|
| Molecular Weight | 135.10 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 135.1048 |
| Heavy Atoms | 10 |
| Complexity | 74.0 |
Chemical Identifiers
| CAS Number | 622-80-0 |
|---|---|
| SMILES | CCCNC1=CC=CC=C1 |
| InChIKey | CDZOGLJOFWFVOZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenamine, N-propyl- (CAS 622-80-0), with molecular formula C9H13N and molecular weight 135.10 g/mol. IUPAC: N-propylaniline.
Chemical Property Profile of Benzenamine, N-propyl-
Property Insights of Benzenamine, N-propyl-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenamine, N-propyl-. With a topological polar surface area (TPSA) of 12.0 Ų, Benzenamine, N-propyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenamine, N-propyl- has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzenamine, N-propyl-?
The CAS number of Benzenamine, N-propyl- is 622-80-0.
What is the molecular formula of Benzenamine, N-propyl-?
The molecular formula of Benzenamine, N-propyl- is C9H13N.
What is the molecular weight of Benzenamine, N-propyl-?
The molecular weight of Benzenamine, N-propyl- is 135.10 g/mol.
Where can I buy Benzenamine, N-propyl-?
You can request a quote for Benzenamine, N-propyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenamine, N-propyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenamine, N-propyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.