CAS RN: 285138-82-1

ACRYLIC ACID-D4

  • Product code: SSC-129917
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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: 0.1g, 0.25g
  • 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 285138-82-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 0 Out of Stock Shanghai Inquiry
0.25g >95% 0 Out of Stock Beijing Inquiry

285138-82-1 / prop-2-enoic acid

Standard CAS: 285138-82-1 Multi CAS: Yes

Basic Information

CAS
285138-82-1
Multi CAS
Yes
Molecular Formula
C3H4O2
Molecular Weight
72.060000
Exact Mass
72.021129
InChI
InChI=1S/C3H4O2/c1-2-3(4)5/h2H,1H2,(H,4,5)
InChIKey
NIXOWILDQLNWCW-UHFFFAOYSA-N

Physical Properties

Melting Point
55 °F (NTP, 1992) 13.56 °C 13 °C 14 °C 55 °F
Boiling Point
286 °F at 760 mmHg (NTP, 1992) 142 °C BP: 122.0 °C at 400 mm Hg; 103.3 °C at 200 mm Hg; 86.1 °C at 100 mm Hg; 66.2 °C at 40 mm Hg; 39.0 °C at 10 mm Hg; 27.3 °C at 5 mm Hg 141.20 °C. @ 760.00 mm Hg 141 °C
Density
1.0497 at 68 °F (USCG, 1999) - Denser than water; will sink 1.0511 g/cu cm at 20 °C Liquid heat capacity: 0.460 BTU/lb-F at 106 °F; Saturated vapor density: 0.00106 lb/cu ft at 70 °F; Ideal gas heat capacity: 0.257 BTU/lb-F at 75 °F Bulk density: 8.6 lb/gal at 20 °C Relative density (water = 1): 1.05
Physical Description
Acrylic acid is a colorless liquid with a distinctive acrid odor. Flash point 130 °F. Boiling point 286 °F. Freezing point 53 °F. Corrosive to metals and tissue. Prolonged exposure to fire or heat can cause polymerization. If polymerization takes place in a closed container, violent rupture may occur. The inhibitor (usually hydroquinone) greatly reduces the tendency to polymerize. Liquid Colorless liquid or solid (below 55 degrees F) with a distinctive, acrid odor; Note: Shipped with an inhibitor (e.g., hydroquinone) since it readily polymerizes; [NIOSH] COLOURLESS LIQUID WITH PUNGENT ODOUR. Colorless liquid or solid (below 55 °F) with a distinctive, acrid odor.
Appearance
Acrid liquid Liquid Colorless liquid Colorless liquid or solid (below 55 degrees F)
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
5
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
17.83
TPSA
37.3

LogP / Solubility

WLOGP
0.26
MLOGP
0.21
XLogP3
0.3
Consensus LogP
0.26
Log S (ESOL)
-0.38
Class (ESOL)
Very soluble
Log S (Ali)
-0.34
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.46
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)
-2.98

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

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