BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL-
TL;DR: BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL- (CAS 63018-70-2) is a chemical compound with molecular formula C20H13N and molecular weight 267.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methylbenzo[a]anthracene-8-carbonitrile
Also Known As: 8-Cyano-7-methylbenz(a)anthracene, 7-methyltetraphene-8-carbonitrile, 5-Cyano-10-methyl-1,2-benzanthracene, 7-Methylbenz[a]anthracene-8-carbonitrile, Benz(a)anthracene, 8-cyano-7-methyl-
| Molecular Formula | C20H13N |
|---|---|
| Molecular Weight | 267.10 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 267.1048 |
| Heavy Atoms | 21 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 63018-70-2 |
|---|---|
| SMILES | CC1=C2C(=CC3=C1C=CC4=CC=CC=C43)C=CC=C2C#N |
| InChIKey | OABWNVLQUOKXFA-UHFFFAOYSA-N |
Product Overview
BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL- (CAS 63018-70-2), with molecular formula C20H13N and molecular weight 267.10 g/mol. IUPAC: 7-methylbenzo[a]anthracene-8-carbonitrile.
Chemical Property Profile of BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL-
Property Insights of BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL-
The XLogP value of 5.8 indicates that BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL-?
The CAS number of BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL- is 63018-70-2.
What is the molecular formula of BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL-?
The molecular formula of BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL- is C20H13N.
What is the molecular weight of BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL-?
The molecular weight of BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL- is 267.10 g/mol.
Where can I buy BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL-?
You can request a quote for BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL-?
Yes, KEHONG BIO provides custom synthesis services for BENZ(a)ANTHRACENE-8-CARBONITRILE, 7-METHYL- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.