CAS RN: 28320-62-9
9,9-Dimethylfluorene-2-carboxylic Acid
Product Availability
Choose a grade to view its available package options.
2 package records1 with current stock1 grade group
- Product code: SSC-129409
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ≥98%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥98% | 0 Out of Stock | Hong Kong | Inquiry |
28320-62-9 / 9,9-dimethylfluorene-2-carboxylic acid
Basic Information
CAS
28320-62-9
Multi CAS
No
Molecular Formula
C16H14O2
Molecular Weight
238.280000
Exact Mass
238.099380
SMILES
CC1(C2=CC=CC=C2C3=C1C=C(C=C3)C(=O)O)C
InChI
InChI=1S/C16H14O2/c1-16(2)13-6-4-3-5-11(13)12-8-7-10(15(17)18)9-14(12)16/h3-9H,1-2H3,(H,17,18)
InChIKey
SJIBSIBHNJAUOR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
12
Fraction Csp3
0.19
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
70.97
TPSA
37.3
LogP / Solubility
WLOGP
3.69
MLOGP
3.25
XLogP3
3.9
Consensus LogP
3.61
Log S (ESOL)
-4.07
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.18
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.39
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.55
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
![CAS 677010-20-7 [1,1′-Biphenyl]-3,4′,5-tricarboxylic Acid molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
[1,1′-Biphenyl]-3,4′,5-tricarboxylic Acid
- CAS RN: 677010-20-7
- Product Code: ICTB5795
- Purity/Analytical method: >98.0%(GC)(T)
-
-
[1,1′-Biphenyl]-3,3′,4,4′-tetracarboxylic Acid
- CAS RN: 22803-05-0
- Product Code: SSC-111022
-
-
-
(±)-cis-3-(Carbobenzoxyamino)cyclohexanecarboxylic Acid
- CAS RN: 952616-39-6
- Product Code: SSC-210588
![CAS 677010-20-7 [1,1′-Biphenyl]-3,4′,5-tricarboxylic Acid molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/b5795-jpgcontextbwfzdgvyfhjvb3r8mzeymdf8aw1hz2uvanblz3xomgyvadfjlzg5mjkymtc3nda4mzavqju3otuuanbnfdkwnjriote3yzezm2u4mdkwmzg5mjmzmgziytmynzq1ndm0ytk5odayyzywywzhnzg2ntdmntbjnwzjztawmwu.jpeg)
![CAS 22803-05-0 [1,1′-Biphenyl]-3,3′,4,4′-tetracarboxylic Acid molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/b6179-jpgcontextbwfzdgvyfhjvb3r8mtgwmzf8aw1hz2uvanblz3xonjkvadfllzkxmzgwmdq0mjy3odivqjyxnzkuanbnfdgznmq4mwnhyzq2mjlhyzg2zjkzzgvmztiyytkwmtq5ytk4ztbmzddmmjlln2qymdjlzgqxnzmymtbmmdc4mtu.jpeg)
