Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride
TL;DR: Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride (CAS 113954-70-4) is a chemical compound with molecular formula C13H18ClNO2 and molecular weight 255.1026 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1'-propan-2-ylspiro[1,3-benzodioxole-2,3'-pyrrolidine];hydrochloride
Also Known As: N-Isopropylspiro(1,3-benzodioxole-2,3'-pyrrolidine) hydrochloride, Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride, 1'-(1-Methylethyl)spiro(1,3-benzodioxole-2,3'-pyrrolidine) hydrochloride, 1'-propan-2-ylspiro[1,3-benzodioxole-2,3'-pyrrolidine] hydrochloride, 1'-(Propan-2-yl)spiro[[1,3]benzodioxole-2,3'-pyrrolidine]--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C13H18ClNO2 |
| Molecular Weight | 255.1026 g/mol |
| XLogP | 2.69 |
| Topological Polar Surface Area (TPSA) | 21.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 255.1026 Da |
| Heavy Atoms | 17 |
| Complexity | 253.0 |
| SMILES | CC(C)N1CCC2(C1)OC3=CC=CC=C3O2.Cl |
| InChIKey | DFBFVCHGXDLTLT-UHFFFAOYSA-N |
Chemical Property Profile of Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride
Property Insights of Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride
The XLogP value of 2.69 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride. With a topological polar surface area (TPSA) of 21.7 Ų, Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride?
The CAS number of Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride is 113954-70-4.
What is the molecular formula of Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride?
The molecular formula of Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride is C13H18ClNO2.
What is the molecular weight of Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride?
The molecular weight of Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride is 255.1026 g/mol.
Where can I buy Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride?
You can request a quote for Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride?
Yes, CoreyChem provides custom synthesis services for Spiro(1,3-benzodioxole-2,3'-pyrrolidine), 1'-(1-methylethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.