(Z)-3-氨基-3-苯基-2-丙烯腈
TL;DR: (Z)-3-氨基-3-苯基-2-丙烯腈 (CAS 1823-99-0) is a chemical compound with molecular formula C9H8N2 and molecular weight 144.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-氨基-3-苯基-2-丙烯腈
3-amino-3-phenylprop-2-enenitrile
Also Known As: Aminocinnamonitrile, 3-Aminocinnamonitrile, 3-Amino-3-phenylacrylonitrile, (Z)-3-amino-3-phenyl-2-propenenitrile, 3-amino-3-phenylprop-2-enenitrile
| Molecular Formula | C9H8N2 |
|---|---|
| Molecular Weight | 144.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 144.06874 |
| Heavy Atoms | 11 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 1823-99-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=CC#N)N |
| InChIKey | GDJDODGBGRBEAN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(Z)-3-氨基-3-苯基-2-丙烯腈 (CAS 1823-99-0), with molecular formula C9H8N2 and molecular weight 144.07 g/mol. IUPAC: 3-amino-3-phenylprop-2-enenitrile.
Chemical Property Profile of (Z)-3-氨基-3-苯基-2-丙烯腈
Property Insights of (Z)-3-氨基-3-苯基-2-丙烯腈
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-3-氨基-3-苯基-2-丙烯腈. With a topological polar surface area (TPSA) of 49.8 Ų, (Z)-3-氨基-3-苯基-2-丙烯腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-3-氨基-3-苯基-2-丙烯腈 has 1 hydrogen bond donor(s) and 2 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 (Z)-3-氨基-3-苯基-2-丙烯腈?
The CAS number of (Z)-3-氨基-3-苯基-2-丙烯腈 is 1823-99-0.
What is the molecular formula of (Z)-3-氨基-3-苯基-2-丙烯腈?
The molecular formula of (Z)-3-氨基-3-苯基-2-丙烯腈 is C9H8N2.
What is the molecular weight of (Z)-3-氨基-3-苯基-2-丙烯腈?
The molecular weight of (Z)-3-氨基-3-苯基-2-丙烯腈 is 144.07 g/mol.
Where can I buy (Z)-3-氨基-3-苯基-2-丙烯腈?
You can request a quote for (Z)-3-氨基-3-苯基-2-丙烯腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-氨基-3-苯基-2-丙烯腈?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-氨基-3-苯基-2-丙烯腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.