1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane - ≥97% , CAS No.119934-12-2

CAS: 119934-12-2 Cat. No.: I627293 Molecular Weight: 262.01 EC Number: 845-014-5 PubChem CID: 9992849
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
SCHEMBL24010798 | EN300-173147 | D79140 | SCHEMBL17582432 | 3-iodo-1-(trifluoromethyl)bicyclo[1.1.1]pentane | BS-41619 | SB22181 | HUDKTQZFLROHKK-UHFFFAOYSA-N | Bicyclo[1.1.1]pentane, 1-iodo-3-(trifluoromethyl)- | SY277716 | 1-iodo-3-(trifluoromethyl)bicy
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
100mg
I627293-100mg
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$103.90

$155.90
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250mg
I627293-250mg
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$164.90

$247.90
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500mg
I627293-500mg
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$296.90

$445.90
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1g
I627293-1g
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$494.90

$742.90
Save $248.00 (33.38%)
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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.

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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

Synonyms
SCHEMBL24010798 | EN300-173147 | D79140 | SCHEMBL17582432 | 3-iodo-1-(trifluoromethyl)bicyclo[1.1.1]pentane | BS-41619 | SB22181 | HUDKTQZFLROHKK-UHFFFAOYSA-N | Bicyclo[1.1.1]pentane, 1-iodo-3-(trifluoromethyl)- | SY277716 | 1-iodo-3-(trifluoromethyl)bicy
Specifications & Purity
≥97%
Storage
Room temperature
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Canonical SmilesC1C2(CC1(C2)I)C(F)(F)F
IUPAC Name1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane
InChIKeyHUDKTQZFLROHKK-UHFFFAOYSA-N
INCHI1S/C6H6F3I/c7-6(8,9)4-1-5(10,2-4)3-4/h1-3H2
Isomeric SMILES C1C2(CC1(C2)I)C(F)(F)F
Alternate CAS 119934-12-2
PubChem CID 9992849
Molecular Weight 262.01

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
SuperclassOrganohalogen compounds
ClassOrganoiodides
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentOrganoiodides
Alternative Parents Organofluorides  Hydrocarbon derivatives  Alkyl iodides  Alkyl fluorides  
Molecular FrameworkAliphatic homopolycyclic compounds
Substituents Hydrocarbon derivative - Organoiodide - Organofluoride - Alkyl iodide - Alkyl halide - Alkyl fluoride - Aliphatic homopolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as organoiodides. These are compounds containing a chemical bond between a carbon atom and an iodine atom.
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 Weight262.010 g/mol
XLogP32.900
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass261.947 Da
Monoisotopic Mass261.947 Da
Topological Polar Surface Area0.000 Ų
Heavy Atom Count10
Formal Charge0
Complexity164.000
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

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