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alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol) structure
Fine Chemical

alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol)

TL;DR: alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol) (CAS 125591-32-4) is a chemical compound with molecular formula C22H27NO4 and molecular weight 369.194 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-(3,4-dihydro-2H-chromen-2-yl)-2-[[2-(3,4-dihydro-2H-chromen-2-yl)-2-hydroxyethyl]amino]ethanol

Also Known As: IMBBM, Didefluoro Nebivolol, Nebivolol Impurity 18, Nebivolol Impurity 36, (Mixture of Diastereomers)

CAS Number
125591-32-4
Molecular Formula
C22H27NO4
Molecular Weight
369.194 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 (2 patents) Pharmaceutical Intermediates (6 patents)

Technical Specifications

Molecular FormulaC22H27NO4
Molecular Weight369.194 g/mol
XLogP2.8
Topological Polar Surface Area (TPSA)71.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors5
Rotatable Bonds6
Exact Mass369.194 Da
Heavy Atoms27
Complexity422.0
SMILESC1CC2=CC=CC=C2OC1C(CNCC(C3CCC4=CC=CC=C4O3)O)O
InChIKeyQSCYKSXNGYFRFZ-UHFFFAOYSA-N

Chemical Property Profile of alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol)

XLogP
2.8
TPSA (Topological Polar Surface Area)
71.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
5
Rotatable Bonds
6
Heavy Atoms
27
Complexity
422.0
Exact Mass
369.194
Monoisotopic Mass
369.194
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 alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol)

The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol). The TPSA of 71.0 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol). Following Lipinski's Rule of Five, alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol) has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol)?

The CAS number of alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol) is 125591-32-4.

What is the molecular formula of alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol)?

The molecular formula of alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol) is C22H27NO4.

What is the molecular weight of alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol)?

The molecular weight of alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol) is 369.194 g/mol.

Where can I buy alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol)?

You can request a quote for alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol)?

Yes, CoreyChem provides custom synthesis services for alpha,alpha'-(iminobis(methylene))bis(3,4-dihydro-2H-1-benzopyran-2-methanol) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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