Benzenemethanol, a-(chloromethyl)-a-methyl-
TL;DR: Benzenemethanol, a-(chloromethyl)-a-methyl- (CAS 19167-98-7) is a chemical compound with molecular formula C9H11ClO and molecular weight 170.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-2-phenylpropan-2-ol
Also Known As: 1-chloro-2-phenylpropan-2-ol, 1-Chloro-2-phenyl-2-propanol, 2-Phenyl-1-chloro-2-propanol, chloro-1 phenyl-2 propanol-2, Benzenemethanol, a-(chloromethyl)-a-methyl-
| Molecular Formula | C9H11ClO |
|---|---|
| Molecular Weight | 170.05 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.04984 |
| Heavy Atoms | 11 |
| Complexity | 121.0 |
Chemical Identifiers
| CAS Number | 19167-98-7 |
|---|---|
| SMILES | CC(CCl)(C1=CC=CC=C1)O |
| InChIKey | VXCZNXLMLBRERI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenemethanol, a-(chloromethyl)-a-methyl- (CAS 19167-98-7), with molecular formula C9H11ClO and molecular weight 170.05 g/mol. IUPAC: 1-chloro-2-phenylpropan-2-ol.
Chemical Property Profile of Benzenemethanol, a-(chloromethyl)-a-methyl-
Property Insights of Benzenemethanol, a-(chloromethyl)-a-methyl-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenemethanol, a-(chloromethyl)-a-methyl-. With a topological polar surface area (TPSA) of 20.2 Ų, Benzenemethanol, a-(chloromethyl)-a-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenemethanol, a-(chloromethyl)-a-methyl- 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 Benzenemethanol, a-(chloromethyl)-a-methyl-?
The CAS number of Benzenemethanol, a-(chloromethyl)-a-methyl- is 19167-98-7.
What is the molecular formula of Benzenemethanol, a-(chloromethyl)-a-methyl-?
The molecular formula of Benzenemethanol, a-(chloromethyl)-a-methyl- is C9H11ClO.
What is the molecular weight of Benzenemethanol, a-(chloromethyl)-a-methyl-?
The molecular weight of Benzenemethanol, a-(chloromethyl)-a-methyl- is 170.05 g/mol.
Where can I buy Benzenemethanol, a-(chloromethyl)-a-methyl-?
You can request a quote for Benzenemethanol, a-(chloromethyl)-a-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanol, a-(chloromethyl)-a-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanol, a-(chloromethyl)-a-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.