DL-2-Amino-1,1,1-trifluoro-3-methylbutane hydrochloride , CAS No.1582-18-9

CAS: 1582-18-9 Cat. No.: S167613 Molecular Weight: 141.13 EC Number: 691-050-8 PubChem CID: 44717389
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Synonyms
SCHEMBL2424797 | 1,1,1-trifluoro-3-methyl-butan-2-amine | 1,1,1-trifluoro-3-methylbutan-2-amine | AMY6777 | 2-Methyl-1-(trifluoromethyl)propylamine | D-2-Amino-1,1,1-trifluoro-3-(methyl)butane | 2-Amino-3-methyl-1,1,1-trifluorobutane | dl-2-amino-3-methyl
Storage
Room temperature
Shipped In
Normal
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Size
Status
Price
Qty
1g
S167613-1g
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Why this grade

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

Synonyms
SCHEMBL2424797 | 1, 1, 1-trifluoro-3-methyl-butan-2-amine | 1, 1, 1-trifluoro-3-methylbutan-2-amine | AMY6777 | 2-Methyl-1-(trifluoromethyl)propylamine | D-2-Amino-1, 1, 1-trifluoro-3-(methyl)butane | 2-Amino-3-methyl-1, 1, 1-trifluorobutane | dl-2-amino-3-methyl
Storage
Room temperature
Shipped In
Normal
Names and Identifiers
Canonical SmilesCC(C)C(C(F)(F)F)N
IUPAC Name1,1,1-trifluoro-3-methylbutan-2-amine
InChIKeyYGGUXSPKQBCCRM-UHFFFAOYSA-N
INCHI1S/C5H10F3N/c1-3(2)4(9)5(6,7)8/h3-4H,9H2,1-2H3
Isomeric SMILES CC(C)C(C(F)(F)F)N
PubChem CID 44717389
Molecular Weight 141.13

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
ClassOrganofluorides
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentOrganofluorides
Alternative Parents Monoalkylamines  Hydrocarbon derivatives  Alkyl fluorides  
Molecular FrameworkAliphatic acyclic compounds
Substituents Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organofluoride - Primary aliphatic amine - Amine - Alkyl halide - Alkyl fluoride - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as organofluorides. These are compounds containing a chemical bond between a carbon atom and a fluorine 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 Weight141.130 g/mol
XLogP31.800
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass141.077 Da
Monoisotopic Mass141.077 Da
Topological Polar Surface Area26.000 Ų
Heavy Atom Count9
Formal Charge0
Complexity86.700
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
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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