2-Aminohexafluoroisopropanol

C₃H₃F₆NOCAS 31253-34-6183.05 g/mol

Open in Covalent MOL file

Alcohol Alkyl halide Primary amine

Properties

Molecular formula: C₃H₃F₆NO
Molar mass: 183.05 g/mol
Exact mass: 183.0119 Da
logP: 0.76Crippen estimate
Polar surface area: 46.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

31253-34-6

SMILES

C(C(F)(F)F)(C(F)(F)F)(N)O

InChIKey

KENSSLIXPGVLRV-UHFFFAOYSA-N

InChI

InChI=1S/C3H3F6NO/c4-2(5,6)1(10,11)3(7,8)9/h11H,10H2

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Names and synonyms

1 names

2-Aminohexafluoropropan-2-ol

Work with 2-Aminohexafluoroisopropanol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Nonafluoro-tert-butyl alcohol2378-02-139 % similar 1,1,1,4,4,4-Hexafluoro-2,3-bis(trifluoromethyl)-2,3-butanediol918-21-839 % similar 2-Bromo-1,1,1,2,3,3,3-heptafluoropropane422-77-537 % similar 1,1,1-Trifluoro-2-methylpropan-2-ol507-52-833 % similar Hexafluoroethane76-16-433 % similar 4-(Trifluoromethyl)-4-piperidinol373603-69-132 % similar 2,2,3,3-Tetrachloro-1,1,1,4,4,4-hexafluorobutane375-34-832 % similar 1,2-Dibromo-1,1,2,3,3,3-hexafluoropropane661-95-030 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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