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3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro-
TL;DR: 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro- (CAS 58084-68-7) is a chemical compound with molecular formula C13H12O and molecular weight 184.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,4,5-tetrahydrocyclopenta[a]naphthalen-3-one
Also Known As: 6,7-Dihydro-benz 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro- (CAS 58084-68-7), with molecular formula C13H12O and molecular weight 184.09 g/mol. IUPAC: 1,2,4,5-tetrahydrocyclopenta[a]naphthalen-3-one.
Molecular Formula
C13H12O
Molecular Weight
184.09 g/mol
LogP
2.7493
Topological Polar Surface Area
17.07 Ų
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
Rotatable Bonds
0
Exact Mass
184.08882
Heavy Atoms
14
Complexity
440.3037
Chemical Identifiers
CAS Number
58084-68-7
SMILES
C1CC2=C(CCC2=O)C3=CC=CC=C31Product Overview
Chemical Property Profile of 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro-
Property Insights of 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro-
The XLogP value of 2.7493 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro-. With a topological polar surface area (TPSA) of 17.07 Ų, 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro- has 0 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 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro-?
The CAS number of 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro- is 58084-68-7.
What is the molecular formula of 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro-?
The molecular formula of 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro- is C13H12O.
What is the molecular weight of 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro-?
The molecular weight of 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro- is 184.09 g/mol.
Where can I buy 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro-?
You can request a quote for 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro-?
Yes, KEHONG BIO provides custom synthesis services for 3H-Benz[e]inden-3-one, 1,2,4,5-tetrahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.