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CAS 123367-26-0 (2E)-3-(Dimethylamino)-1-(3-pyridyl)prop-2-en-1-one molecular structure lightbox
CAS RN: 123367-26-0

(2E)-3-(Dimethylamino)-1-(3-pyridyl)prop-2-en-1-one

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260624 100g In stock Inquiry
Batchno.20250613 1g In stock Inquiry
Batchno.20260516 25g In stock Inquiry
Batchno.20251023 5g In stock Inquiry
  • Product code: SSC-027064
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 5g, 1g, 10g, 25g
  • Available purity: >97%
  • Inventory rows with stock: 2
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 123367-26-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g -- 1 In Stock Beijing Inquiry
5g >97% 1 In Stock Hong Kong Inquiry
1g -- 0 Out of Stock Beijing Inquiry
1g >97% 0 Out of Stock Beijing Inquiry
10g -- 0 Out of Stock Shanghai Inquiry
10g >97% 0 Out of Stock Beijing Inquiry
25g -- 0 Out of Stock Shenzhen Inquiry
25g >97% 0 Out of Stock Shenzhen Inquiry

123367-26-0 / (E)-3-(dimethylamino)-1-pyridin-3-ylprop-2-en-1-one

Standard CAS: 123367-26-0 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
123367-26-0
Multi CAS
No
Molecular Formula
C10H12N2O
Molecular Weight
176.210000
Exact Mass
176.094963
SMILES
CN(C)/C=C/C(=O)C1=CN=CC=C1
InChI
InChI=1S/C10H12N2O/c1-12(2)7-5-10(13)9-4-3-6-11-8-9/h3-8H,1-2H3/b7-5+
InChIKey
MZLRFUCMBQWLNV-FNORWQNLSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.2
Rotatable bonds
3
H-bond acceptors
3
Molar refractivity
51.39
TPSA
33.2

LogP / Solubility

WLOGP
1.34
MLOGP
1.18
XLogP3
0.8
Consensus LogP
1.11
Log S (ESOL)
-1.92
Class (ESOL)
Soluble
Log S (Ali)
-1.97
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)
-2.84

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)
Irritant Health Hazard
Signal
Warning
GHS Hazard Statements
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (25%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation] H317 (25%): May cause an allergic skin reaction [Warning Sensitization, Skin] H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P260, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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