Structure

N-(5-Hydroxypentyl)trifluoroacetamide

CAS
128238-44-8
Catalog Number
ACM128238448
Category
Amino Alcohols
Molecular Weight
199.17
Molecular Formula
C7H12F3NO2

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Specification

Synonyms
N-(5-Hydroxypentyl)trifluoroacetamide, 5-(Trifluoroacetamido)-1-pentanol, 128238-44-8, AC1NAXN1, 2,2,2-trifluoro-N-(5-hydroxypentyl)acetamide, ACMC-1CB47, 91681_ALDRICH, 91681_FLUKA, CTK0H0451, AKOS015909979, AG-D-58375, Acetamide, 2,2,2-trifluoro-N-(5-hydroxypentyl)-, I14-32662, N-Trifluoroacetyl-5-aminopentanol;2,2,2-Trifluoro-N-(5-hydroxypentyl)acetamide;5-(Trifluoroacetylamino)-1-pentanol;N-Trifluoroacetyl-5-amino-1-pentanol;
IUPAC Name
2,2,2-trifluoro-N-(5-hydroxypentyl)acetamide
Canonical SMILES
C(CCNC(=O)C(F)(F)F)CCO
InChI Key
SCHGQSPQAJAJRI-UHFFFAOYSA-N
Boiling Point
273ºC at 760 mmHg
Flash Point
109ºC
Density
1.248 g/mL at 20ºC(lit.)
Exact Mass
199.08200
Hazard Statements
H226-H314
H-Bond Acceptor
5
H-Bond Donor
2
RIDADR
NONH for all modes of transport
Safety Description
26-36
Symbol
GHS02
What is the molecular formula of N-(5-Hydroxypentyl)trifluoroacetamide?

The molecular formula is C7H12F3NO2.

What is the molecular weight of N-(5-Hydroxypentyl)trifluoroacetamide?

The molecular weight is 199.17 g/mol.

What is the IUPAC name of N-(5-Hydroxypentyl)trifluoroacetamide?

The IUPAC name is 2,2,2-trifluoro-N-(5-hydroxypentyl)acetamide.

What is the InChI code of N-(5-Hydroxypentyl)trifluoroacetamide?

The InChI code is InChI=1S/C7H12F3NO2/c8-7(9,10)6(13)11-4-2-1-3-5-12/h12H,1-5H2,(H,11,13).

What is the InChIKey of N-(5-Hydroxypentyl)trifluoroacetamide?

The InChIKey is SCHGQSPQAJAJRI-UHFFFAOYSA-N.

What is the canonical SMILES of N-(5-Hydroxypentyl)trifluoroacetamide?

The canonical SMILES is C(CCNC(=O)C(F)(F)F)CCO.

What is the CAS number of N-(5-Hydroxypentyl)trifluoroacetamide?

The CAS number is 128238-44-8.

What is the European Community (EC) number of N-(5-Hydroxypentyl)trifluoroacetamide?

The European Community (EC) number is 621-300-3.

What is the DSSTox Substance ID of N-(5-Hydroxypentyl)trifluoroacetamide?

The DSSTox Substance ID is DTXSID60403497.

Is N-(5-Hydroxypentyl)trifluoroacetamide a canonicalized compound?

Yes, N-(5-Hydroxypentyl)trifluoroacetamide is canonicalized.

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