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2-chloro-N,N-bis(3-methylbutyl)acetamide structure
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2-chloro-N,N-bis(3-methylbutyl)acetamide

TL;DR: 2-chloro-N,N-bis(3-methylbutyl)acetamide (CAS 100395-94-6) is a chemical compound with molecular formula C12H24ClNO and molecular weight 233.15465 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-chloro-N,N-bis(3-methylbutyl)acetamide

Also Known As: 2-chloro-N,N-bis(3-methylbutyl)acetamide, 2-chloro-N,N-bis-(3-methyl-butyl)-acetamide, 2-Chlor-N,N-diisopentyl-acetamid, Acetamide, 2-chloro-N,N-bis(3-methylbutyl)-, chloro-acetic acid diisopentylamide

CAS Number
100395-94-6
Molecular Formula
C12H24ClNO
Molecular Weight
233.15465 g/mol
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Technical Specifications

Molecular FormulaC12H24ClNO
Molecular Weight233.15465 g/mol
XLogP3.7
Topological Polar Surface Area (TPSA)20.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors1
Rotatable Bonds7
Exact Mass233.15465 Da
Heavy Atoms15
Complexity168.0
SMILESCC(C)CCN(CCC(C)C)C(=O)CCl
InChIKeyKPTCQTDZEHPOQF-UHFFFAOYSA-N

Chemical Property Profile of 2-chloro-N,N-bis(3-methylbutyl)acetamide

XLogP
3.7
TPSA (Topological Polar Surface Area)
20.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
Rotatable Bonds
7
Heavy Atoms
15
Complexity
168.0
Exact Mass
233.15465
Monoisotopic Mass
233.15465
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-chloro-N,N-bis(3-methylbutyl)acetamide

The XLogP value of 3.7 indicates that 2-chloro-N,N-bis(3-methylbutyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 2-chloro-N,N-bis(3-methylbutyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N,N-bis(3-methylbutyl)acetamide 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

What is the CAS number of 2-chloro-N,N-bis(3-methylbutyl)acetamide?

The CAS number of 2-chloro-N,N-bis(3-methylbutyl)acetamide is 100395-94-6.

What is the molecular formula of 2-chloro-N,N-bis(3-methylbutyl)acetamide?

The molecular formula of 2-chloro-N,N-bis(3-methylbutyl)acetamide is C12H24ClNO.

What is the molecular weight of 2-chloro-N,N-bis(3-methylbutyl)acetamide?

The molecular weight of 2-chloro-N,N-bis(3-methylbutyl)acetamide is 233.15465 g/mol.

Where can I buy 2-chloro-N,N-bis(3-methylbutyl)acetamide?

You can request a quote for 2-chloro-N,N-bis(3-methylbutyl)acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-chloro-N,N-bis(3-methylbutyl)acetamide?

Yes, CoreyChem provides custom synthesis services for 2-chloro-N,N-bis(3-methylbutyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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