BENZO(a)PYRENE, 3,12-DIMETHYL-
TL;DR: BENZO(a)PYRENE, 3,12-DIMETHYL- (CAS 16757-84-9) is a chemical compound with molecular formula C22H16 and molecular weight 280.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,12-dimethylbenzo[a]pyrene
Also Known As: 3,12-dimethylbenzo[a]pyrene, 3,12-Dimethylbenzo(a)pyrene, BENZO(a)PYRENE, 3,12-DIMETHYL-, Benzo[a]pyrene, 3,12-dimethyl-, 3,12-Dimethylbenzo[pqr]tetraphene
| Molecular Formula | C22H16 |
|---|---|
| Molecular Weight | 280.13 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 280.1252 |
| Heavy Atoms | 22 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 16757-84-9 |
|---|---|
| SMILES | CC1=C2C=CC3=CC4=CC=CC=C4C5=C3C2=C(C=C1)C(=C5)C |
| InChIKey | AXNVFWFDUHHFDK-UHFFFAOYSA-N |
Product Overview
BENZO(a)PYRENE, 3,12-DIMETHYL- (CAS 16757-84-9), with molecular formula C22H16 and molecular weight 280.13 g/mol. IUPAC: 3,12-dimethylbenzo[a]pyrene.
Chemical Property Profile of BENZO(a)PYRENE, 3,12-DIMETHYL-
Property Insights of BENZO(a)PYRENE, 3,12-DIMETHYL-
The XLogP value of 6.7 indicates that BENZO(a)PYRENE, 3,12-DIMETHYL- 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(a)PYRENE, 3,12-DIMETHYL- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BENZO(a)PYRENE, 3,12-DIMETHYL- 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(a)PYRENE, 3,12-DIMETHYL-?
The CAS number of BENZO(a)PYRENE, 3,12-DIMETHYL- is 16757-84-9.
What is the molecular formula of BENZO(a)PYRENE, 3,12-DIMETHYL-?
The molecular formula of BENZO(a)PYRENE, 3,12-DIMETHYL- is C22H16.
What is the molecular weight of BENZO(a)PYRENE, 3,12-DIMETHYL-?
The molecular weight of BENZO(a)PYRENE, 3,12-DIMETHYL- is 280.13 g/mol.
Where can I buy BENZO(a)PYRENE, 3,12-DIMETHYL-?
You can request a quote for BENZO(a)PYRENE, 3,12-DIMETHYL- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BENZO(a)PYRENE, 3,12-DIMETHYL-?
Yes, KEHONG BIO provides custom synthesis services for BENZO(a)PYRENE, 3,12-DIMETHYL- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.