Butanal, 3-chloro-, (S)-
TL;DR: Butanal, 3-chloro-, (S)- (CAS 61494-39-1) is a chemical compound with molecular formula C4H7ClO and molecular weight 106.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-chlorobutanal
Also Known As: Butanal, 3-chloro-, (S)-, (3S)-3-Chlorobutanal
| Molecular Formula | C4H7ClO |
|---|---|
| Molecular Weight | 106.02 g/mol |
| LogP | 1.2027 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 106.01854 |
| Heavy Atoms | 6 |
| Complexity | 42.812744 |
Chemical Identifiers
| CAS Number | 61494-39-1 |
|---|---|
| SMILES | C[C@@H](CC=O)Cl |
Product Overview
Butanal, 3-chloro-, (S)- (CAS 61494-39-1), with molecular formula C4H7ClO and molecular weight 106.02 g/mol. IUPAC: (3S)-3-chlorobutanal.
Chemical Property Profile of Butanal, 3-chloro-, (S)-
Property Insights of Butanal, 3-chloro-, (S)-
The XLogP value of 1.2027 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanal, 3-chloro-, (S)-. With a topological polar surface area (TPSA) of 17.07 Ų, Butanal, 3-chloro-, (S)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butanal, 3-chloro-, (S)- has 0 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 Butanal, 3-chloro-, (S)-?
The CAS number of Butanal, 3-chloro-, (S)- is 61494-39-1.
What is the molecular formula of Butanal, 3-chloro-, (S)-?
The molecular formula of Butanal, 3-chloro-, (S)- is C4H7ClO.
What is the molecular weight of Butanal, 3-chloro-, (S)-?
The molecular weight of Butanal, 3-chloro-, (S)- is 106.02 g/mol.
Where can I buy Butanal, 3-chloro-, (S)-?
You can request a quote for Butanal, 3-chloro-, (S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanal, 3-chloro-, (S)-?
Yes, KEHONG BIO provides custom synthesis services for Butanal, 3-chloro-, (S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.