2-Butenoic acid, 3-phenyl-
TL;DR: 2-Butenoic acid, 3-phenyl- (CAS 704-79-0) is a chemical compound with molecular formula C10H10O2 and molecular weight 162.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-phenylbut-2-enoic acid
Also Known As: 3-phenylbut-2-enoic acid, (E)-3-phenylbut-2-enoic acid, 3-Phenylcrotonic acid, 2-Butenoic acid, 3-phenyl-, beta-Methylcinnamic acid
| Molecular Formula | C10H10O2 |
|---|---|
| Molecular Weight | 162.07 g/mol |
| LogP | 2.1745 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 162.06808 |
| Heavy Atoms | 12 |
| Complexity | 298.87442 |
Chemical Identifiers
| CAS Number | 704-79-0 |
|---|---|
| SMILES | C/C(=C\C(=O)O)/C1=CC=CC=C1 |
Product Overview
2-Butenoic acid, 3-phenyl- (CAS 704-79-0), with molecular formula C10H10O2 and molecular weight 162.07 g/mol. IUPAC: (E)-3-phenylbut-2-enoic acid.
Chemical Property Profile of 2-Butenoic acid, 3-phenyl-
Property Insights of 2-Butenoic acid, 3-phenyl-
The XLogP value of 2.1745 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butenoic acid, 3-phenyl-. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Butenoic acid, 3-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butenoic acid, 3-phenyl- has 1 hydrogen bond donor(s) and 1 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 2-Butenoic acid, 3-phenyl-?
The CAS number of 2-Butenoic acid, 3-phenyl- is 704-79-0.
What is the molecular formula of 2-Butenoic acid, 3-phenyl-?
The molecular formula of 2-Butenoic acid, 3-phenyl- is C10H10O2.
What is the molecular weight of 2-Butenoic acid, 3-phenyl-?
The molecular weight of 2-Butenoic acid, 3-phenyl- is 162.07 g/mol.
Where can I buy 2-Butenoic acid, 3-phenyl-?
You can request a quote for 2-Butenoic acid, 3-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butenoic acid, 3-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Butenoic acid, 3-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.