![CAS 619-25-0 3-Nitrobenzyl Alcohol [Matrix for FABMS and liquid SIMS] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/s0378-jpgcontextbwfzdgvyfhjvb3r8nda5mdb8aw1hz2uvanblz3xoyjevagnjlzg5mziymta3mdq0mtqvuzaznzguanbnfdnhngrimjawodrjmmriywnkogu3nzhkmzm1mdcxmthlzme4ntq2ntfhzjdiotvjnzjimzu4ytuwmgvmmmriyje.jpeg)
CAS RN: 619-25-0
3-Nitrobenzyl Alcohol [Matrix for FABMS and liquid SIMS]
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250520 | 1g / 5g / 25g / 100g | Confirm by inquiry | Hebei, Shanghai, Shandong, Guangdong | Inquiry |
- Product code: SSC-170890
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 5g, 10g, 25g, 100g
- Available purity: >97%
- Inventory rows with stock: 2
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
619-25-0 / (3-nitrophenyl)methanol
Basic Information
CAS
619-25-0
Multi CAS
Yes
Molecular Formula
C7H7NO3
Molecular Weight
153.140000
Exact Mass
153.042593
InChI
InChI=1S/C7H7NO3/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4,9H,5H2
InChIKey
CWNPOQFCIIFQDM-UHFFFAOYSA-N
Physical Properties
Physical Description
Liquid; mp = 30-32 deg C
State
Liquid
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
39.02
TPSA
63.37
LogP / Solubility
WLOGP
1.09
MLOGP
0.95
XLogP3
1.2
Consensus LogP
1.08
Log S (ESOL)
-1.75
Class (ESOL)
Soluble
Log S (Ali)
-1.6
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.8
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.88
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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