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CAS 106-62-7 2-(2-Hydroxypropoxy)-1-propanol molecular structure lightbox
CAS RN: 106-62-7

2-(2-Hydroxypropoxy)-1-propanol

  • Product code: SSC-007654
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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: 1g
  • Available purity: ≥95%
  • 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 106-62-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

106-62-7 / 2-(2-hydroxypropoxy)propan-1-ol

1,1'-OXYDI-2-PROPANOL | 2-Propanol, 1,1'-oxybis- | Bis(2-hydroxypropyl) ether

Standard CAS: 106-62-7 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
106-62-7
Multi CAS
Yes
Molecular Formula
C6H14O3
Molecular Weight
134.170000
Exact Mass
134.094294
SMILES
CC(CO)OCC(C)O
InChI
InChI=1S/C6H14O3/c1-5(8)4-9-6(2)3-7/h5-8H,3-4H2,1-2H3
InChIKey
DUFKCOQISQKSAV-UHFFFAOYSA-N
Synonyms
1,1'-OXYDI-2-PROPANOL 2-Propanol, 1,1'-oxybis- Bis(2-hydroxypropyl) ether 1-(2-hydroxypropoxy)propan-2-ol 4-Oxaheptane-2,6-diol

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
2
Molar refractivity
34.18
TPSA
49.69

LogP / Solubility

WLOGP
-0.24
MLOGP
-0.22
XLogP3
-0.7
Consensus LogP
-0.39
Log S (ESOL)
-0.26
Class (ESOL)
Very soluble
Log S (Ali)
-0.49
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.82
Class (SILICOS-IT)
Very 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)
-3.71

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

Safety & Transport

GHS Hazard Statements
Not Classified Reported as not meeting GHS hazard criteria by 1 of 1 companies. For more detailed information, please visit ECHA C&L website.

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