N- (Hydroxymethyl) trifluoroacetamide

CAT: 0127-PC49320-01Size: 5 gDry Ice: NoHazardous: No

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CAT#:0127-PC49320-01Size:5 g

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CAS Number

50667-69-1

Synonyms

N- (Hydroxymethyl) -2,2,2-trifluoroacetamide, (Trifluoroacetamido) methanol

MDL Number

MFCD00014416

Purity

97%

Smiles

OCNC(=O)C(F)(F)F

Chemical Information

2,2,2-Trifluoro-N-(hydroxymethyl)acetamide

N-(hydroxymethyl)trifluoroacetamide is a carboximidic acid.

CAS Number	50667-69-1
PubChem CID	3084931
IUPAC Name	2,2,2-trifluoro-N-(hydroxymethyl)acetamide
Molecular Formula	C3H4F3NO2
Molecular Weight	143.06
XLogP	0.1
Topological Polar Surface Area	49.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Heavy Atom Count	9
Formal Charge	0
Complexity	110

SMILES

C(NC(=O)C(F)(F)F)O

InChI

InChI=1S/C3H4F3NO2/c4-3(5,6)2(9)7-1-8/h8H,1H2,(H,7,9)

InChIKey

URUWXKFAEKTWKG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 50667-69-1

CID: 3084931

Formula: C3H4F3NO2

MW: 143.06

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	143.06
XLogP3	0.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Exact Mass	143.01941286
Monoisotopic Mass	143.01941286
Topological Polar Surface Area	49.3 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	110
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
PC5202-01	N-Methylbis (trifluoroacetamide)
PC3047-01	N-Methylbis (trifluoroacetamide)
BIM110	N- (Iodoethyl) trifluoroacetamide
PC0132-01	N-Methyl-N- (trimethylsilyl) trifluoroacetamide
PC48421	N- (4-Aminophenyl) trifluoroacetamide
PC7150-01	Trifluoroacetamide
PC49182	N- (4-Hydrazinophenyl) trifluoroacetamide hydrochloride
PC108818-01	N, N-Diallyl-2,2,2-Trifluoroacetamide
PC4048-01	N, N-Diethyl-2,2,2-trifluoroacetamide
PC109140-01	N-Benzyl-2,2,2-Trifluoroacetamide

Catalog	Name
FH103419-01	N- (Hydroxymethyl) trifluoroacetamide
MBS6055230-01	N-(4-Hydroxymethylbenzyl)trifluoroacetamide (2,2,2-Trifluoro-N-(4-hydroxymethyl-benzyl)-acetamide)
H9110-13Q	N- (4-Hydroxymethylbenzyl) trifluoroacetamide (2,2,2-Trifluoro-N- (4-hydroxymethyl-benzyl) -acetamide)
TRC-B451215-2.5G	N-[2-[Bis(4-methoxyphenyl)phenylmethoxy]-1-(hydroxymethyl)ethyl]-2,2,2-trifluoroacetamide
BCA98921-01	N-[2- (2,4-Dioxopyrimidin-1-yl) -4-hydroxy-5- (hydroxymethyl) oxolan-3-yl]-2,2,2-trifluoroacetamide
AR-A05332-01	Trifluoroacetamide
290212-01	P-Toluidine trifluoroacetamide
14757349-01	Bis (trimethylsilyl) trifluoroacetamide
284845-01	N-Methylbis (trifluoroacetamide)
sc-476490	N- (Trifluoromethanesulfonyl) trifluoroacetamide