C14H20ClNO.ClH
TL;DR: C14H20ClNO.ClH (CAS 49800-19-3) is a chemical compound with molecular formula C14H21Cl2NO and molecular weight 289.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S)-8-chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-propan-2-ylazanium chloride
Also Known As: [(1S)-8-chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-propan-2-ylazanium chloride|1-Naphthylamine, 1,2,3,4-tetrahydro-8-chloro-N-isopropyl-5-methoxy-, hydrochloride, (S)-|1-Naphthylamine, 8-chloro-N-isopropyl-5-methoxy-1,2,3,4-tetrahydro-, hydrochloride, (S)|1-NAPHTHYLAMINE, 1,2,3,4-TETRAHYDRO-8-CHLORO-N-ISOPROPYL-5-METHOXY-, HYDROCHLORI|1-Naphthalenamine, 8-chloro-1,2,3,4-tetrahydro-5-methoxy-N-(1-methylethyl)-, hydrochloride, (S)-|8-Chloro-5-methoxy-N-(propan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine--hydrogen chloride (1/1)|RefChem:1074681|DTXCID401392113
| Molecular Formula | C14H21Cl2NO |
|---|---|
| Molecular Weight | 289.10 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 25.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.1 |
| Heavy Atoms | 18 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 49800-19-3 |
|---|---|
| SMILES | CC(C)[NH2+][C@H]1CCCC2=C(C=CC(=C12)Cl)OC.[Cl-] |
| InChIKey | DUYLFGMDTTXULZ-YDALLXLXSA-N |
Product Overview
C14H20ClNO.ClH (CAS 49800-19-3), with molecular formula C14H21Cl2NO and molecular weight 289.10 g/mol. IUPAC: [(1S)-8-chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-propan-2-ylazanium chloride.
Chemical Property Profile of C14H20ClNO.ClH
Property Insights of C14H20ClNO.ClH
The XLogP value of -0.3 indicates that C14H20ClNO.ClH is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 25.8 Ų, C14H20ClNO.ClH exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C14H20ClNO.ClH 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 C14H20ClNO.ClH?
The CAS number of C14H20ClNO.ClH is 49800-19-3.
What is the molecular formula of C14H20ClNO.ClH?
The molecular formula of C14H20ClNO.ClH is C14H21Cl2NO.
What is the molecular weight of C14H20ClNO.ClH?
The molecular weight of C14H20ClNO.ClH is 289.10 g/mol.
Where can I buy C14H20ClNO.ClH?
You can request a quote for C14H20ClNO.ClH directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C14H20ClNO.ClH?
Yes, KEHONG BIO provides custom synthesis services for C14H20ClNO.ClH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.