Carbamic acid, (5-bromo-3-thienyl)-, 1,1-dimethylethyl ester


Chemical Name: Carbamic acid, (5-bromo-3-thienyl)-, 1,1-dimethylethyl ester
CAS Number: 494833-75-9
Product Number: AG00DD5E(AGN-PC-0NKVZI)
Synonyms:
MDL No:
Molecular Formula: C9H12BrNO2S
Molecular Weight: 278.1661

Identification/Properties


Properties
MP:
88-91°C
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
278.164g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
276.977g/mol
Monoisotopic Mass:
276.977g/mol
Topological Polar Surface Area:
66.6A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
217
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:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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