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(4-Oxo-1,4-dihydropyrimido[1,2-a]benzimidazol-2-yl)acetic acid - ≥97% , CAS No.940980-97-2

(4-Oxo-1,4-dihydropyrimido[1,2-a]benzimidazol-2-yl)acetic acid - ≥97% , CAS No.940980-97-2

Name: (4-Oxo-1,4-dihydropyrimido[1,2-a]benzimidazol-2-yl)acetic acid - ≥97% , CAS No.940980-97-2
Brand: Aladdin Scientific
SKU: O1303946
Availability: InStock

CAS: 940980-97-2 Cat. No.: O1303946 PubChem CID: 16641395

COA

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AVAILABLE TO ORDER

GRADE & PURITY ≥97%

Storage

Room temperature

Specifications Names and Identifiers Documentation Advanced Data 3D Structure Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solution Calculators Reviews

🧪

Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Specifications & Purity

≥97%

Storage

Room temperature

Purity

≥97%

Names and Identifiers

Canonical Smiles	C1=CC=C2C(=C1)N=C3N2C(=O)C=C(N3)CC(=O)O
IUPAC Name	2-(4-oxo-1H-pyrimido[1,2-a]benzimidazol-2-yl)acetic acid
InChIKey	XOWGDFZASXYENF-UHFFFAOYSA-N
INCHI	1S/C12H9N3O3/c16-10-5-7(6-11(17)18)13-12-14-8-3-1-2-4-9(8)15(10)12/h1-5H,6H2,(H,13,14)(H,17,18)
Isomeric SMILES	C1=CC=C2C(=C1)N=C3N2C(=O)C=C(N3)CC(=O)O
PubChem CID	16641395

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

3D Structure

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	243.220 g/mol
XLogP3	1.000
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	243.064 Da
Monoisotopic Mass	243.064 Da
Topological Polar Surface Area	84.200 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	421.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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