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CAS 120747-84-4 2-Amino-5-pyrimidinecarboxyaldehyde molecular structure lightbox
CAS RN: 120747-84-4

2-Amino-5-pyrimidinecarboxyaldehyde

Product Availability

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4 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251109 1g In stock Inquiry
Batchno.20260701 250mg In stock Inquiry
Batchno.20260121 5g Out of stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250704 250mg / 1g / 5g / 25g Confirm by inquiry Shanghai, Guangdong Inquiry
  • Product code: SSC-021975
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Verified Factory Data

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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: 1g, 5g, 10g, 25g, 0.25g, 100g
  • Available purity: >98%
  • Inventory rows with stock: 5
  • 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 120747-84-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >98% 5 In Stock Shenzhen Inquiry
5g >98% 5 In Stock Shanghai Inquiry
10g >98% 5 In Stock Shanghai Inquiry
25g >98% 4 In Stock Hong Kong Inquiry
0.25g >98% 2 In Stock Beijing Inquiry
100g >98% 0 Out of Stock Shenzhen Inquiry

120747-84-4 / 2-aminopyrimidine-5-carbaldehyde

2-Aminopyrimidine-5-carbaldehyde | DTXSID40354332 | RefChem:256054

Standard CAS: 120747-84-4 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
120747-84-4
Multi CAS
No
Molecular Formula
C5H5N3O
Molecular Weight
123.110000
Exact Mass
123.043262
SMILES
C1=C(C=NC(=N1)N)C=O
InChI
InChI=1S/C5H5N3O/c6-5-7-1-4(3-9)2-8-5/h1-3H,(H2,6,7,8)
InChIKey
DPOYRRAYGKTRAU-UHFFFAOYSA-N
Synonyms
2-Aminopyrimidine-5-carbaldehyde DTXSID40354332 RefChem:256054 DTXCID70305392 682-941-2

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
31.83
TPSA
68.87

LogP / Solubility

WLOGP
-0.13
MLOGP
-0.12
XLogP3
-0.7
Consensus LogP
-0.32
Log S (ESOL)
-0.95
Class (ESOL)
Very soluble
Log S (Ali)
-0.48
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.47
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)
-3.56

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
Signal
Warning
GHS Hazard Statements
H302 (98%): Harmful if swallowed [Warning Acute toxicity, oral] H317 (78.4%): May cause an allergic skin reaction [Warning Sensitization, Skin]
Precautionary Statement Codes
P261, P264, P270, P272, P280, P301+P317, P302+P352, P321, P330, P333+P317, P362+P364, and P501

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