2-[4-(Propan-2-yloxy)phenyl]-1,3-thiazole-4-carboxylic acid - ≥95% , CAS No.1047308-85-9

CAS: 1047308-85-9 Cat. No.: P1253939 Molecular Weight: 263.31 EC Number: 154-594-2 PubChem CID: 46065534
AVAILABLE TO ORDER
GRADE & PURITY ≥95%
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
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Status
Price
Qty
50mg
P1253939-50mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$152.90
100mg
P1253939-100mg
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$206.90
250mg
P1253939-250mg
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$265.90
500mg
P1253939-500mg
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$447.90
1g
P1253939-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$618.90
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Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

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

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Quality documents

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

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Literature proof

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

Specifications

Specifications & Purity
≥95%
Storage
Room temperature
Shipped In
Normal
Purity
≥95%
Names and Identifiers
Canonical SmilesCC(C)OC1=CC=C(C=C1)C2=NC(=CS2)C(=O)O
IUPAC Name2-(4-propan-2-yloxyphenyl)-1,3-thiazole-4-carboxylic acid
InChIKeyLLGQEFDWPCXNSC-UHFFFAOYSA-N
INCHI1S/C13H13NO3S/c1-8(2)17-10-5-3-9(4-6-10)12-14-11(7-18-12)13(15)16/h3-8H,1-2H3,(H,15,16)
PubChem CID 46065534
Molecular Weight 263.31

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.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassAzoles
SubclassThiazoles
Intermediate Tree Nodes Not available
Direct ParentThiazolecarboxylic acids and derivatives
Alternative Parents Phenoxy compounds  Phenol ethers  Alkyl aryl ethers  2,4-disubstituted thiazoles  Heteroaromatic compounds  Carboxylic acids  Azacyclic compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Phenoxy compound - Phenol ether - Thiazolecarboxylic acid or derivatives - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Ether - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as thiazolecarboxylic acids and derivatives. These are heterocyclic compounds containing a thiazole ring which bears a carboxylic acid group (or a derivative thereof).
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Molecular Weight263.310 g/mol
XLogP33.200
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass263.062 Da
Monoisotopic Mass263.062 Da
Topological Polar Surface Area87.700 Ų
Heavy Atom Count18
Formal Charge0
Complexity290.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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