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1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine structure
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1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine

TL;DR: 1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine (CAS 103990-05-2) is a chemical compound with molecular formula C11H17NO and molecular weight 179.13101 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-(4-propan-2-yloxyphenyl)ethanamine

Also Known As: 1-(4-Isopropoxy-phenyl)-ethylamine, 1-(4-Isopropoxyphenyl)ethanamine, 1-[4-(propan-2-yloxy)phenyl]ethan-1-amine, 1-(4-propan-2-yloxyphenyl)ethanamine, p-Isopropoxy-alpha-methylbenzylamine

CAS Number
103990-05-2
Molecular Formula
C11H17NO
Molecular Weight
179.13101 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (1 patents) Pharmaceutical Intermediates (3 patents)

Technical Specifications

Molecular FormulaC11H17NO
Molecular Weight179.13101 g/mol
XLogP2.0
Topological Polar Surface Area (TPSA)35.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds3
Exact Mass179.13101 Da
Heavy Atoms13
Complexity139.0
SMILESCC(C)OC1=CC=C(C=C1)C(C)N
InChIKeyQDLPHPPYMUBDRB-UHFFFAOYSA-N

Chemical Property Profile of 1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine

XLogP
2.0
TPSA (Topological Polar Surface Area)
35.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
3
Heavy Atoms
13
Complexity
139.0
Exact Mass
179.13101
Monoisotopic Mass
179.13101
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 1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine

The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine. With a topological polar surface area (TPSA) of 35.3 Ų, 1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine 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

What is the CAS number of 1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine?

The CAS number of 1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine is 103990-05-2.

What is the molecular formula of 1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine?

The molecular formula of 1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine is C11H17NO.

What is the molecular weight of 1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine?

The molecular weight of 1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine is 179.13101 g/mol.

Where can I buy 1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine?

You can request a quote for 1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine?

Yes, CoreyChem provides custom synthesis services for 1-[4-(Propan-2-yloxy)phenyl]ethan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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