4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2,6-dimethylaniline

HCID 9882425CAS 273735-43-6
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1cc(C(F)(C(F)(F)F)C(F)(F)F)cc(C)c1N
InChIKey
XXGNKVWIUWGEOH-UHFFFAOYSA-N
Molecular formula
C11H10F7N
Average molar mass
289.19 g/mol
Monoisotopic mass
289.07014686

Names & identifiers

Preferred name
4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2,6-dimethylaniline
IUPAC
4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2,6-dimethylaniline
English name
2,6-diMethyl-4-(perfluoropropan-2-yl)aniline
Molecular formula
C11H10F7N
Molecular weight
289.19

Names & synonyms

273735-43-64-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2,6-dimethylanilineDTXSID20896341RefChem:286494DTXCID9013258342,6-dimethyl-4-(perfluoropropan-2-yl)anilineMFCD220562574-heptafluoroisopropyl-2,6-dimethylanilineSCHEMBL698408C11H10F7N2,6-dimethyl-4-(1,2,2,2-tetrafluoro-1-trifluoromethyl-ethyl)-phenylamineAKOS025149136
Show more names
Benzenamine, 2,6-dimethyl-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]-
DB-355343NS001097562,6-Dimethyl-4-(heptafluoroprop-2-yl)anilineEN300-651113H420762,6-dimethyl-4-(heptafluoro-prop-2-yl)-aniline4-(heptafluoropropan-2-yl)-2,6-dimethylaniline2,6-dimethyl-4-(heptafluoro-prop-2-y1)-aniline

Database identifiers

CAS
273735-43-6
PubChem CID
9882425
DTXSID
DTXSID20896341

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
26 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
1
Heavy atoms
19

Experimental & physicochemical properties

PFAS · 2 items

PFAS -> Other/unspecified

PFAS -> OECD Category

Physicochemical properties

EPA Substance Registry System
4 · 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2,6-dimethylaniline (273735-43-6)

Chemistry & industry

Uses & manufacturing

Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category

Suppliers9 total

Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
吉林中科研伸科技有限公司0431-80514535 19917294565 · [email protected]

Related reactions

15 records
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Linked notes

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