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N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide
TL;DR: N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide (CAS 712303-27-0) is a chemical compound with molecular formula C13H18ClNO and molecular weight 239.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide
Also Known As: N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide, N-[(4-chlorophenyl)methyl]-3,3-dimethyl-butanamide
| Molecular Formula | C13H18ClNO |
|---|---|
| Molecular Weight | 239.11 g/mol |
| LogP | 3.3924 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 239.1077 |
| Heavy Atoms | 16 |
| Complexity | 351.1905 |
Chemical Identifiers
| CAS Number | 712303-27-0 |
|---|---|
| SMILES | CC(C)(C)CC(=O)NCC1=CC=C(C=C1)Cl |
Product Overview
N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide (CAS 712303-27-0), with molecular formula C13H18ClNO and molecular weight 239.11 g/mol. IUPAC: N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide.
Chemical Property Profile of N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide
Property Insights of N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide
The XLogP value of 3.3924 indicates that N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide 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 N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide?
The CAS number of N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide is 712303-27-0.
What is the molecular formula of N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide?
The molecular formula of N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide is C13H18ClNO.
What is the molecular weight of N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide?
The molecular weight of N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide is 239.11 g/mol.
Where can I buy N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide?
You can request a quote for N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-chlorophenyl)methyl]-3,3-dimethylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.