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CAS 94-33-7 2-hydroxyethyl benzoate molecular structure lightbox
CAS RN: 94-33-7

2-hydroxyethyl benzoate

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250413 1g In stock Inquiry
Batchno.20250720 250mg In stock Inquiry
Batchno.20250909 50mg In stock Inquiry
Batchno.20250220 5g In stock Inquiry
  • Product code: SSC-208540
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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 94-33-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

94-33-7 / ethyl 2-hydroxybenzoate

Standard CAS: 94-33-7 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
94-33-7
Multi CAS
Yes
Molecular Formula
C9H10O3
Molecular Weight
166.170000
Exact Mass
166.062994
InChI
InChI=1S/C9H10O3/c1-2-12-9(11)7-5-3-4-6-8(7)10/h3-6,10H,2H2,1H3
InChIKey
GYCKQBWUSACYIF-UHFFFAOYSA-N

Physical Properties

Melting Point
1.3 °C
Boiling Point
233.00 to 235.00 °C. @ 760.00 mm Hg
Density
1.125-1.131
Physical Description
Liquid Clear colorless to very light yellow liquid with a pleasant odor like wintergreen; [Merck Index] Colorless liquid; colourless to pale yellow liquid with a spicy, anisic, wintergreen-like odour
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.22
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
44.06
TPSA
46.53

LogP / Solubility

WLOGP
1.57
MLOGP
1.38
XLogP3
3
Consensus LogP
1.98
Log S (ESOL)
-2.1
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.06
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.28
Class (SILICOS-IT)
Moderately 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)
-2.62

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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