2-[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetic acid - ≥97% , CAS No.957487-30-8

CAS: 957487-30-8 Cat. No.: C1363631 Molecular Weight: 234.18 EC Number: 890-238-9 PubChem CID: 6485414
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
500mg
C1363631-500mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$756.90
1g
C1363631-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$837.90
5g
C1363631-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$1,654.90
10g
C1363631-10g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$2,266.90
25g
C1363631-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$4,000.90
Enter a quantity for the sizes you want to add.
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Why this grade

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

🌡

Storage & shipping

Room temperature Ships Normal 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
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Canonical SmilesC1CC1C2=CC(=NN2CC(=O)O)C(F)(F)F
IUPAC Name2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]acetic acid
InChIKeyWAWOVUXKYBKOBQ-UHFFFAOYSA-N
INCHI1S/C9H9F3N2O2/c10-9(11,12)7-3-6(5-1-2-5)14(13-7)4-8(15)16/h3,5H,1-2,4H2,(H,15,16)
Isomeric SMILES C1CC1C2=CC(=NN2CC(=O)O)C(F)(F)F
PubChem CID 6485414
Molecular Weight 234.18

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
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 Weight234.170 g/mol
XLogP31.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass234.062 Da
Monoisotopic Mass234.062 Da
Topological Polar Surface Area55.100 Ų
Heavy Atom Count16
Formal Charge0
Complexity291.000
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
Reviews

Customer Reviews

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