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CAS 1852-16-0 N-(Butoxymethyl)acrylamide (stabilized with MEHQ) molecular structure lightbox
CAS RN: 1852-16-0

N-(Butoxymethyl)acrylamide (stabilized with MEHQ)

  • Product code: SSC-085716
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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: 25ml
  • 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 1852-16-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
25ml ≥95% 0 Out of Stock Shenzhen Inquiry

1852-16-0 / N-(butoxymethyl)prop-2-enamide

Standard CAS: 1852-16-0 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
1852-16-0
Multi CAS
No
Molecular Formula
C8H15NO2
Molecular Weight
157.210000
Exact Mass
157.110279
SMILES
CCCCOCNC(=O)C=C
InChI
InChI=1S/C8H15NO2/c1-3-5-6-11-7-9-8(10)4-2/h4H,2-3,5-7H2,1H3,(H,9,10)
InChIKey
UTSYWKJYFPPRAP-UHFFFAOYSA-N

Physical Properties

Physical Description
Liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.62
Rotatable bonds
6
H-bond acceptors
2
H-bond donors
1
Molar refractivity
44.07
TPSA
38.33

LogP / Solubility

WLOGP
1.06
MLOGP
0.93
XLogP3
1.3
Consensus LogP
1.1
Log S (ESOL)
-1.09
Class (ESOL)
Soluble
Log S (Ali)
-1.62
Class (Ali)
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)
-2.92

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
1.5

Safety & Transport

Pictogram(s)
Acute Toxic Irritant Health Hazard
Signal
Danger
GHS Hazard Statements
H301 (27.3%): Toxic if swallowed [Danger Acute toxicity, oral] H302 (72.7%): Harmful if swallowed [Warning Acute toxicity, oral] H311 (28.1%): Toxic in contact with skin [Danger Acute toxicity, dermal] H312 (64%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (40.3%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement Codes
P203, P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P318, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 P210, P260, P262, P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P308+P316, P316, P321, P330, P337+P317, P361+P364, P370+P378, P403, P405, and P501

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