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CAS 75-84-3 2,2-Dimethyl-1-propanol molecular structure lightbox
CAS RN: 75-84-3

2,2-Dimethyl-1-propanol

Product Availability

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2 package records2 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250420 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong, Guangdong, Chongqing Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251201 25g In stock Shanghai Inquiry
  • Product code: SSC-184518
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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: 5g, 10g, 25g, 100g
  • Available purity: >97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 75-84-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >97% 0 Out of Stock Shanghai Inquiry
10g >97% 0 Out of Stock Hong Kong Inquiry
25g >97% 0 Out of Stock Shanghai Inquiry
100g >97% 0 Out of Stock Beijing Inquiry

75-84-3 / 2,2-dimethylpropan-1-ol

Standard CAS: 75-84-3 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
75-84-3
Multi CAS
No
Molecular Formula
C5H12O
Molecular Weight
88.150000
Exact Mass
88.088815
InChI
InChI=1S/C5H12O/c1-5(2,3)4-6/h6H,4H2,1-3H3
InChIKey
KPSSIOMAKSHJJG-UHFFFAOYSA-N

Physical Properties

Melting Point
53 °C
Boiling Point
114 °C
Density
0.812 @ 20 °C/4 °C Liquid density = 851.5 kg/cu m
Physical Description
Volatile solid with an odor of peppermint; [Merck Index] Colorless to white solid; [CHEMINFO] White crystalline solid
Appearance
CRYSTALS
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
26.54
TPSA
20.23

LogP / Solubility

WLOGP
1.02
MLOGP
0.89
XLogP3
1.3
Consensus LogP
1.07
Log S (ESOL)
-1.03
Class (ESOL)
Soluble
Log S (Ali)
-1.02
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.08
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)
-2.53

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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