Carbamic acid, (2-mercaptoethyl)-, 1,1-dimethylethyl ester


Chemical Name: Carbamic acid, (2-mercaptoethyl)-, 1,1-dimethylethyl ester
CAS Number: 67385-09-5
Product Number: AG003EZT(AGN-PC-0KNWYU)
Synonyms:
MDL No:
Molecular Formula: C7H15NO2S
Molecular Weight: 177.2645

Identification/Properties


Properties
BP:
68 °C0.3 mm Hg(lit.)
Storage:
Inert atmosphere;2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.474(lit.)
Computed Properties
Molecular Weight:
177.262g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
177.082g/mol
Monoisotopic Mass:
177.082g/mol
Topological Polar Surface Area:
39.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
131
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

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3077
Hazard Statements:
H315-H319-H413
Precautionary Statements:
P501-P273-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Class:
9
Packing Group:

NMR Spectrum


Other Analytical Data


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