Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans-
TL;DR: Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans- (CAS 65649-31-2) is a chemical compound with molecular formula C22H18 and molecular weight 282.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(12cS,12dS)-12c,12d-dimethylbenzo[e]pyrene
Also Known As: (12cS,12dS)-12c,12d-dimethylbenzo[e]pyrene, 12c,12d-Dihydro-12c,12d-dimethylbenzo(e)pyrene trans-, Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans-, (12cS,12dS)-12c,12d-dimethyl-12cH,12dH-benzo[e]pyrene, 12cbeta,12dalpha-Dimethyl-12c,12d-dihydrobenzo[e]pyrene
| Molecular Formula | C22H18 |
|---|---|
| Molecular Weight | 282.14 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 282.14084 |
| Heavy Atoms | 22 |
| Complexity | 672.0 |
Chemical Identifiers
| CAS Number | 65649-31-2 |
|---|---|
| SMILES | C[C@@]12C3=CC=C4[C@]1(C(=CC=C4)C5=CC=CC=C5C2=CC=C3)C |
| InChIKey | OBPJXRUDZSZEIW-VXKWHMMOSA-N |
Product Overview
Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans- (CAS 65649-31-2), with molecular formula C22H18 and molecular weight 282.14 g/mol. IUPAC: (12cS,12dS)-12c,12d-dimethylbenzo[e]pyrene.
Chemical Property Profile of Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans-
Property Insights of Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans-
The XLogP value of 6.2 indicates that Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans- has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans-?
The CAS number of Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans- is 65649-31-2.
What is the molecular formula of Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans-?
The molecular formula of Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans- is C22H18.
What is the molecular weight of Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans-?
The molecular weight of Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans- is 282.14 g/mol.
Where can I buy Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans-?
You can request a quote for Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans-?
Yes, KEHONG BIO provides custom synthesis services for Benzo(e)pyrene, 12c,12d-dihydro-12c,12d-dimethyl-, trans- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.