1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene)
TL;DR: 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene) (CAS 25805-16-7) is a chemical compound with molecular formula C19H20N2O4 and molecular weight 340.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butane-1,4-diol;1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene
Also Known As: Polyurethane Y-302, Butanediol-MDI copolymer, Sanprene LQX 31, MDI-1,4-butanediol copolymer, 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene)
| Molecular Formula | C19H20N2O4 |
|---|---|
| Molecular Weight | 340.14 g/mol |
| LogP | 2.9632 |
| Topological Polar Surface Area | 99.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 340.1423 |
| Heavy Atoms | 25 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 25805-16-7 |
|---|---|
| SMILES | C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCO)CO |
| InChIKey | PFOLXKOIZDGHPB-UHFFFAOYSA-N |
Product Overview
1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene) (CAS 25805-16-7), with molecular formula C19H20N2O4 and molecular weight 340.14 g/mol. IUPAC: butane-1,4-diol;1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene.
Chemical Property Profile of 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene)
Property Insights of 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene)
The XLogP value of 2.9632 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene). The TPSA of 99.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene). Following Lipinski's Rule of Five, 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene) has 2 hydrogen bond donor(s) and 6 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 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene)?
The CAS number of 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene) is 25805-16-7.
What is the molecular formula of 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene)?
The molecular formula of 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene) is C19H20N2O4.
What is the molecular weight of 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene)?
The molecular weight of 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene) is 340.14 g/mol.
Where can I buy 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene)?
You can request a quote for 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene)?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Butanediol, polymer with 1,1'-methylenebis(4-isocyanatobenzene) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.