NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO-
TL;DR: NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO- (CAS 95454-87-8) is a chemical compound with molecular formula C16H15NO3 and molecular weight 269.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-2-nitrobenzo[e][1]benzofuran
Also Known As: 1-Butyl-2-nitronaphtho(2,1-b)furan, 1-N-Butyl-2-nitronaphtho(2,1-b)furan, NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO-, R 7429, 1-butyl-2-nitrobenzo[e][1]benzofuran
| Molecular Formula | C16H15NO3 |
|---|---|
| Molecular Weight | 269.11 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.1052 |
| Heavy Atoms | 20 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 95454-87-8 |
|---|---|
| SMILES | CCCCC1=C(OC2=C1C3=CC=CC=C3C=C2)[N+](=O)[O-] |
| InChIKey | NEQZRASRDHGIAQ-UHFFFAOYSA-N |
Product Overview
NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO- (CAS 95454-87-8), with molecular formula C16H15NO3 and molecular weight 269.11 g/mol. IUPAC: 1-butyl-2-nitrobenzo[e][1]benzofuran.
Chemical Property Profile of NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO-
Property Insights of NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO-
The XLogP value of 5.6 indicates that NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.0 Ų, NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO-?
The CAS number of NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO- is 95454-87-8.
What is the molecular formula of NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO-?
The molecular formula of NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO- is C16H15NO3.
What is the molecular weight of NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO-?
The molecular weight of NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO- is 269.11 g/mol.
Where can I buy NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO-?
You can request a quote for NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO-?
Yes, KEHONG BIO provides custom synthesis services for NAPHTHO(2,1-b)FURAN, 1-BUTYL-2-NITRO- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.