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Ethanimidic acid, N-methoxy-, ethyl ester

HCID 89471
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Basic information

CAS
21250-85-1
Standard SMILES
CCOC(C)=NOC
InChIKey
NZYMDDNXBAMPRN-UHFFFAOYSA-N
Molecular formula
C5H11NO2
Average molar mass
117.15 g/mol
Monoisotopic mass
117.07897859

Names & identifiers

Preferred name
Ethanimidic acid, N-methoxy-, ethyl ester
IUPAC
ethyl N-methoxyethanimidate
English name
N-Methoxyethanimidic acid ethyl ester
Molecular formula
C5H11NO2
Molecular weight
117.15

Names & synonyms

Ethanimidic acid, N-methoxy-, ethyl ester21250-85-1N-Methoxyethanimidic acid, ethyl esterDTXSID7066693RefChem:591865DTXCID2036451ethyl N-methoxyethanimidateNZYMDDNXBAMPRN-UHFFFAOYSA-NN-Methoxyethanimidic acid ethyl ester

Database identifiers

CAS
21250-85-1
PubChem CID
89471
DTXSID
DTXSID7066693

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
30.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
8
Formal charge
0
Complexity
80.5

Physicochemical properties

Boiling point
44 · 44-46 °C(Press: 55 Torr)
Density
0.91 · 0.91±0.1 g/cm3(Predicted)
EPA Substance Registry System
Ethanimidic acid, N-methoxy-, ethyl ester (21250-85-1)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationEthanimidic acid, N-methoxy-, ethyl ester: INACTIVE

Related reactions

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Compound notes

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