trans-2-(trifluoromethyl)cyclopropane-1-carboxylic acid - ≥97% , CAS No.78376-99-5

CAS: 78376-99-5 Cat. No.: T682935 Molecular Weight: 154.09 EC Number: 807-832-0 PubChem CID: 13379936
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Storage
Store at 2-8°C
Shipped In
Wet ice
 ·  off list, applied to all prices below.
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Status
Price
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100mg
T682935-100mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$467.90
250mg
T682935-250mg
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$745.90
500mg
T682935-500mg
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$1,241.90
1g
T682935-1g
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$1,862.90
5g
T682935-5g
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$5,587.90
10g
T682935-10g
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$9,312.90
25g
T682935-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$18,624.90
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Why this grade

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

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice 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
Store at 2-8°C
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥97%
Names and Identifiers
Canonical SmilesC1C(C1C(F)(F)F)C(=O)O
IUPAC Name(1R,2R)-2-(trifluoromethyl)cyclopropane-1-carboxylic acid
InChIKeyGSNLYQDUCHEFFQ-PWNYCUMCSA-N
INCHI1S/C5H5F3O2/c6-5(7,8)3-1-2(3)4(9)10/h2-3H,1H2,(H,9,10)/t2-,3-/m1/s1
Isomeric SMILES C1[C@H]([C@@H]1C(F)(F)F)C(=O)O
PubChem CID 13379936
Molecular Weight 154.09

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

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic acids and derivatives
ClassCarboxylic acids and derivatives
SubclassCyclopropanecarboxylic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentCyclopropanecarboxylic acids
Alternative Parents Monocarboxylic acids and derivatives  Carboxylic acids  Organofluorides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  Alkyl fluorides  
Molecular FrameworkAliphatic homomonocyclic compounds
Substituents Cyclopropanecarboxylic acid - Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl fluoride - Aliphatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as cyclopropanecarboxylic acids. These are organic compounds containing a carboxyl group attached to a cyclopropane ring.
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 Weight154.090 g/mol
XLogP31.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass154.024 Da
Monoisotopic Mass154.024 Da
Topological Polar Surface Area37.300 Ų
Heavy Atom Count10
Formal Charge0
Complexity163.000
Isotope Atom Count0
Defined Atom Stereocenter Count2
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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