N-(trifluoroacetyl)aminoacetic acid

HCID 136227CAS 383-70-0
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(O)CNC(=O)C(F)(F)F
InChIKey
IFAXXCBMQJNCCF-UHFFFAOYSA-N
Molecular formula
C4H4F3NO3
Average molar mass
171.07 g/mol
Monoisotopic mass
171.01432748

Names & identifiers

Preferred name
N-(trifluoroacetyl)aminoacetic acid
IUPAC
2-[(2,2,2-trifluoroacetyl)amino]acetic acid
English name
N-(Trifluoroacetyl)glycine
Molecular formula
C4H4F3NO3
Molecular weight
171.07

Names & synonyms

383-70-0TFA-GLY-OHN-(Trifluoroacetyl)glycineN-(Trifluoroacetyl)aminoacetic acid2-[(2,2,2-trifluoroacetyl)amino]acetic acidCHEBI:145713DTXSID30191672NSC 306126(2,2,2-TRIFLUOROACETAMIDO)ACETIC ACID2-((2,2,2-trifluoroacetyl)amino)acetic acidRefChem:162440DTXCID70114163
Show more names
TFA-GlyTFA-GLYCINETRIFLUOROACETYL GLYCINEL- trifluoroacetyl glycineglycine,N-(trifluoroacetyl)-N-alpha-Trifluoracetyl-glycinN-ALPHA-TRIFLUOROACETYL-GLYCINE
IFAXXCBMQJNCCF-UHFFFAOYSA-N2-(2,2,2-Trifluoroacetamido)acetic acidN-TrifluoroacetylglycineMFCD00029784N-Trifluoroacetyl glycine(2,2,2-Trifluoroacetyl)glycineTrifluoroacetylglycine[(Trifluoroacetyl)amino]acetic acid

Database identifiers

CAS
383-70-0
PubChem CID
136227
DTXSID
DTXSID30191672
ChEBI
CHEBI:145713
EC Number
828-193-4
Nikkaji
J429.865I

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
66.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
11

Physicochemical properties

Melting point
120 · 120-121 °C
Boiling point
291.6 °C · 291.6°C
Density
1.534 · 1.534
Flash point
130 °C · 130°C
storage temp.
Sealed in dry,Room Temperature
solubility
Chloroform, DMSO

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H335-H315-H302-H319
Precautionary statements
P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

Chemistry & industry

Applications

UsesN-Trifluoroacetylglycine (cas# 383-70-0) is a compound useful in organic synthesis.

Upstream & downstream products

Suppliers50 total

阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Additional notes · 1 item

DefinitionChEBI: N-(trifluoroacetyl)glycine is an N-acylglycine resulting from the formal condensation of the amino group of glycine with the carboxy group of trifluoroacetic acid. It is a N-acylglycine, a secondary carboxamide and a trifluoroacetamide.

Related reactions

12 records
New reaction record

Linked notes

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