Ethyl thiooxamate - CAS 16982-21-1

Catalog:	BB012580
Product Name:	Ethyl thiooxamate
CAS:	16982-21-1
Synonyms:	ethyl 2-amino-2-sulfanylideneacetate

Technical Data

Patents

Computed Properties

IUPAC Name:	ethyl 2-amino-2-sulfanylideneacetate
Description:	Ethyl thiooxamate (CAS# 16982-21-1) is a compound useful in organic synthesis.
Molecular Weight:	133.17
Molecular Formula:	C4H7NO2S
Canonical SMILES:	CCOC(=O)C(=S)N
InChI:	InChI=1S/C4H7NO2S/c1-2-7-4(6)3(5)8/h2H2,1H3,(H2,5,8)
InChI Key:	YMBMCMOZIGSBOA-UHFFFAOYSA-N
Boiling Point:	199.2 ℃ at 760 mmHg
Density:	1.247 g/cm³
MDL:	MFCD00074903
LogP:	0.53590

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1427004-19-0]
DBCO-PEG4-NHS ester
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[59855-96-8]
2-(Methoxymethyl)thiazole-5-carboxylic Acid

Sulfur Compounds

[6633-90-5]
1,4-Butanedithiol diacetate
[42729-26-0]
3-(Trifluoromethylthio)phenyl isothiocyanate
[117717-02-9]
3-Chloro-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazol-4-amine hydrochloride
[313685-03-9]
Ethyl 1-[(4-chlorophenyl)sulfonyl]piperidine-4-carboxylate
[594-45-6]
Ethanesulfonic acid
[308103-56-2]
Ethanesulfonic acid sodium salt monohydrate

Complexity:	113
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	133.01974964
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	133.01974964
Rotatable Bond Count:	3
Topological Polar Surface Area:	84.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.4