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2-Acetamidoethyl acetate

HCID 85319
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
16180-96-4
Standard SMILES
CC(=O)NCCOC(C)=O
InChIKey
SKPWGBMKZNVXFF-UHFFFAOYSA-N
Molecular formula
C6H11NO3
Average molar mass
145.16 g/mol
Monoisotopic mass
145.07389321

Names & identifiers

Preferred name
2-Acetamidoethyl acetate
IUPAC
2-acetamidoethyl acetate
English name
2-acetamidoethyl acetate
Molecular formula
C6H11NO3
Molecular weight
145.16

Names & synonyms

2-Acetamidoethyl acetateAcetamide, N-[2-(acetyloxy)ethyl]-N-[2-(Acetyloxy)ethyl]acetamideEINECS 240-317-3Acetamide, N-(2-(acetyloxy)ethyl)-DTXSID1066021N-(2-(acetyloxy)ethyl)acetamideRefChem:462775DTXCID9035204240-317-316180-96-42-(acetylamino)ethyl acetate
Show more names
Nicorandil Impurity 21N-(2-ACETOXYETHYL)ACETAMIDE3-((2-hydroxyethyl)carbamoyl)pyridine 1-oxide
Nicorandil Impurity 53N-acetoxyethylacetamideKP9WF9WKM41-Acetamido-2-acetoxyethaneEthanolamine, N,O-diacetyl-SCHEMBL279485SCHEMBL7659780SCHEMBL8318938

Database identifiers

CAS
16180-96-4
PubChem CID
85319
DTXSID
DTXSID1066021
UNII
KP9WF9WKM4
EC Number
240-317-3
Nikkaji
J286.836I

Properties

Computed structural properties

XLogP
-0.6
Topological polar surface area
55.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
10
Formal charge
0
Complexity
133

Physicochemical properties

Boiling point
103 °C · 103 °C(Press: 0.049 Torr)
Density
1.059 · 1.059±0.06 g/cm3(Predicted)
pka
15.62 · 15.62±0.46(Predicted)
EPA Substance Registry System
2 · Acetamide, N-[2-(acetyloxy)ethyl]- (16180-96-4)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
319 · H319
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P
TSCA
TSCA listed

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory InformationChemical: Acetamide, N-[2-(acetyloxy)ethyl]-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and CategoriesEye Irrit. 2 (100%)

Safety data

tsca
TSCA listed
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H319
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationAcetamide, N-[2-(acetyloxy)ethyl]-: INACTIVE

Suppliers12 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
湖北扬信医药科技有限公司15374522761 · [email protected]
湖北瑞诺医药科技有限公司13165688766 · [email protected]
Shaanxi Dideu New Materials Co. Ltd18192503167 · [email protected]
北京爱科姆科技有限公司17710328343 · [email protected]
深圳市恒丰万达医药科技有限公司18126517264 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
江苏艾康生物医药研发有限公司17714375163 · [email protected]
湖北清北云研医药科技有限责任公司18162595016; 18162595016 · [email protected]

Related reactions

4 records
New reaction record
HRID 689411 reaction equation
HRID 689411As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1763086 reaction equation
HRID 1763086As productuspto-grants-1989_05
HRID 1763087 reaction equation
HRID 1763087As productuspto-grants-1989_05
HRID 2159192 reaction equation
HRID 2159192As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes