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CAS 99-66-1 2-Propylvaleric Acid molecular structure lightbox
CAS RN: 99-66-1

2-Propylvaleric Acid

Product Availability

Choose a grade to view its available package options.

7 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260216 100g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20251011 1kg In stock Shanghai, Tianjin Inquiry
Batchno.20250211 500g In stock Shanghai, Tianjin, Chengdu Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260122 100ml In stock Shanghai, Shandong, Guangdong, Chongqing, Hebei Inquiry
Batchno.20250423 2.5L In stock Shandong Inquiry
Batchno.20250616 25ml In stock Shanghai, Shandong, Chongqing, Hebei Inquiry
Batchno.20260622 500ml In stock Shanghai, Shandong Inquiry
  • Product code: SSC-212943
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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: 25ml, 100ml, 500ml
  • Available purity: >97%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 99-66-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
25ml >97% 5 In Stock Hong Kong Inquiry
100ml >97% 2 In Stock Shenzhen Inquiry
500ml >97% 1 In Stock Shanghai Inquiry

99-66-1 / 2-propylpentanoic acid

Standard CAS: 99-66-1 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
99-66-1
Multi CAS
Yes
Molecular Formula
C8H16O2
Molecular Weight
144.210000
Exact Mass
144.115030
InChI
InChI=1S/C8H16O2/c1-3-5-7(6-4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)
InChIKey
NIJJYAXOARWZEE-UHFFFAOYSA-N

Physical Properties

Boiling Point
428 °F at 760 mmHg (NTP, 1992) 219.5 °C BP: 219 to 220 °C 222 °C
Density
0.922 at 32 °F (NTP, 1992) - Less dense than water; will float 0.904 g/cu cm at 25 °C
Physical Description
Valproic acid is a clear colorless liquid. (NTP, 1992) Liquid
Appearance
Colorless liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.88
Rotatable bonds
5
H-bond acceptors
1
H-bond donors
1
Molar refractivity
40.94
TPSA
37.3

LogP / Solubility

WLOGP
2.29
MLOGP
2.01
XLogP3
2.8
Consensus LogP
2.37
Log S (ESOL)
-1.85
Class (ESOL)
Soluble
Log S (Ali)
-2.39
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.1
Class (SILICOS-IT)
Poorly 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)
-1.98

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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