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Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1) structure
Fine Chemical

Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1)

TL;DR: Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1) (CAS 101022-73-5) is a chemical compound with molecular formula C11H15ClN2O and molecular weight 226.0873 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-(3,4-dihydro-2H-pyrrol-5-ylamino)-2-methylphenol;hydrochloride

Also Known As: 3-(3,4-dihydro-2H-pyrrol-5-ylamino)-2-methylphenol, 3-(3,4-dihydro-2H-pyrrol-5-ylamino)-2-methylphenol hydrochloride, Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1)

CAS Number
101022-73-5
Molecular Formula
C11H15ClN2O
Molecular Weight
226.0873 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 (6 patents) Pharmaceutical Intermediates (1 patents)

Technical Specifications

Molecular FormulaC11H15ClN2O
Molecular Weight226.0873 g/mol
XLogP2.72662
Topological Polar Surface Area (TPSA)44.6 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors2
Rotatable Bonds2
Exact Mass226.0873 Da
Heavy Atoms15
Complexity227.0
SMILESCC1=C(C=CC=C1O)NC2=NCCC2.Cl
InChIKeyROSNMDWAWBBSHV-UHFFFAOYSA-N

Chemical Property Profile of Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1)

XLogP
2.72662
TPSA (Topological Polar Surface Area)
44.6
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
2
Rotatable Bonds
2
Heavy Atoms
15
Complexity
227.0
Exact Mass
226.0873
Monoisotopic Mass
226.0873
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 Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1)

The XLogP value of 2.72662 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1). With a topological polar surface area (TPSA) of 44.6 Ų, Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1) has 3 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 Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1)?

The CAS number of Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1) is 101022-73-5.

What is the molecular formula of Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1)?

The molecular formula of Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1) is C11H15ClN2O.

What is the molecular weight of Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1)?

The molecular weight of Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1) is 226.0873 g/mol.

Where can I buy Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1)?

You can request a quote for Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1)?

Yes, CoreyChem provides custom synthesis services for Phenol, 3-[(3,4-dihydro-2H-pyrrol-5-yl)amino]-2-methyl-, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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