(1)-3-(Dimethylamino)-2-methylpropiophenone
TL;DR: (1)-3-(Dimethylamino)-2-methylpropiophenone (CAS 51370-97-9) is a chemical compound with molecular formula C13H21NO3 and molecular weight 239.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7-hydroxy-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)methyl 3-methylbut-2-enoate
Also Known As: (1)-3-(Dimethylamino)-2-methylpropiophenone, (1alpha,7alpha,7abeta)-(-)-(Hexahydro-7-hydroxy-1H-pyrrolizin-1-yl)methyl 3-methyl-2-butenoate, 2-Butenoic acid, 3-methyl-, (hexahydro-7-hydroxy-1H-pyrrolizin-1-yl)methyl ester, (1alpha,7alpha,7abeta)-(-)-, (7-Hydroxyhexahydro-1H-pyrrolizin-1-yl)methyl 3-methylbut-2-enoate, (7-hydroxy-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)methyl 3-methylbut-2-enoate
| Molecular Formula | C13H21NO3 |
|---|---|
| Molecular Weight | 239.15 g/mol |
| LogP | 0.9509 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 239.15215 |
| Heavy Atoms | 17 |
| Complexity | 322.62625 |
Chemical Identifiers
| CAS Number | 51370-97-9 |
|---|---|
| SMILES | CC(=CC(=O)OCC1CCN2C1C(CC2)O)C |
Product Overview
(1)-3-(Dimethylamino)-2-methylpropiophenone (CAS 51370-97-9), with molecular formula C13H21NO3 and molecular weight 239.15 g/mol. IUPAC: (7-hydroxy-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)methyl 3-methylbut-2-enoate.
Chemical Property Profile of (1)-3-(Dimethylamino)-2-methylpropiophenone
Property Insights of (1)-3-(Dimethylamino)-2-methylpropiophenone
The XLogP value of 0.9509 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1)-3-(Dimethylamino)-2-methylpropiophenone. With a topological polar surface area (TPSA) of 49.77 Ų, (1)-3-(Dimethylamino)-2-methylpropiophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1)-3-(Dimethylamino)-2-methylpropiophenone has 1 hydrogen bond donor(s) and 4 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)-3-(Dimethylamino)-2-methylpropiophenone?
The CAS number of (1)-3-(Dimethylamino)-2-methylpropiophenone is 51370-97-9.
What is the molecular formula of (1)-3-(Dimethylamino)-2-methylpropiophenone?
The molecular formula of (1)-3-(Dimethylamino)-2-methylpropiophenone is C13H21NO3.
What is the molecular weight of (1)-3-(Dimethylamino)-2-methylpropiophenone?
The molecular weight of (1)-3-(Dimethylamino)-2-methylpropiophenone is 239.15 g/mol.
Where can I buy (1)-3-(Dimethylamino)-2-methylpropiophenone?
You can request a quote for (1)-3-(Dimethylamino)-2-methylpropiophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1)-3-(Dimethylamino)-2-methylpropiophenone?
Yes, KEHONG BIO provides custom synthesis services for (1)-3-(Dimethylamino)-2-methylpropiophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.