Benzo(a)pyren-5-amine
TL;DR: Benzo(a)pyren-5-amine (CAS 16602-35-0) is a chemical compound with molecular formula C20H13N and molecular weight 267.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzo[a]pyren-5-amine
Also Known As: Benzo(a)pyren-5-amine, benzo[a]pyren-5-amine, Benzo[pqr]tetraphen-5-amine
| Molecular Formula | C20H13N |
|---|---|
| Molecular Weight | 267.10 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 267.1048 |
| Heavy Atoms | 21 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 16602-35-0 |
|---|---|
| SMILES | C1=CC=C2C3=C4C(=CC2=C1)C(=CC5=CC=CC(=C54)C=C3)N |
| InChIKey | YZRSNODSSGCSLZ-UHFFFAOYSA-N |
Product Overview
Benzo(a)pyren-5-amine (CAS 16602-35-0), with molecular formula C20H13N and molecular weight 267.10 g/mol. IUPAC: benzo[a]pyren-5-amine.
Chemical Property Profile of Benzo(a)pyren-5-amine
Property Insights of Benzo(a)pyren-5-amine
The XLogP value of 5.3 indicates that Benzo(a)pyren-5-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, Benzo(a)pyren-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(a)pyren-5-amine has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzo(a)pyren-5-amine?
The CAS number of Benzo(a)pyren-5-amine is 16602-35-0.
What is the molecular formula of Benzo(a)pyren-5-amine?
The molecular formula of Benzo(a)pyren-5-amine is C20H13N.
What is the molecular weight of Benzo(a)pyren-5-amine?
The molecular weight of Benzo(a)pyren-5-amine is 267.10 g/mol.
Where can I buy Benzo(a)pyren-5-amine?
You can request a quote for Benzo(a)pyren-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo(a)pyren-5-amine?
Yes, KEHONG BIO provides custom synthesis services for Benzo(a)pyren-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.