ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)-
TL;DR: ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)- (CAS 64398-92-1) is a chemical compound with molecular formula C9H10ClNO and molecular weight 183.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-(oxiran-2-ylmethyl)aniline
Also Known As: 4-chloro-N-(oxiran-2-ylmethyl)aniline, ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)-, N-(2:3-Epoxy-n-propyl)-p-chloro-aniline, Oxiranemethanamine, N-(4-chlorophenyl)-, 4-Chloro-N-[(oxiran-2-yl)methyl]aniline
| Molecular Formula | C9H10ClNO |
|---|---|
| Molecular Weight | 183.05 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 24.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 183.04509 |
| Heavy Atoms | 12 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 64398-92-1 |
|---|---|
| SMILES | C1C(O1)CNC2=CC=C(C=C2)Cl |
| InChIKey | VVQPMDOXICEFEH-UHFFFAOYSA-N |
Product Overview
ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)- (CAS 64398-92-1), with molecular formula C9H10ClNO and molecular weight 183.05 g/mol. IUPAC: 4-chloro-N-(oxiran-2-ylmethyl)aniline.
Chemical Property Profile of ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)-
Property Insights of ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)-. With a topological polar surface area (TPSA) of 24.6 Ų, ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)- 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
Frequently Asked Questions
What is the CAS number of ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)-?
The CAS number of ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)- is 64398-92-1.
What is the molecular formula of ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)-?
The molecular formula of ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)- is C9H10ClNO.
What is the molecular weight of ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)-?
The molecular weight of ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)- is 183.05 g/mol.
Where can I buy ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)-?
You can request a quote for ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)-?
Yes, KEHONG BIO provides custom synthesis services for ANILINE, p-CHLORO-N-(2,3-EPOXYPROPYL)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.