Carbamic acid, (4-isothiocyanatophenyl)-, 1,1-dimethylethyl ester


Chemical Name: Carbamic acid, (4-isothiocyanatophenyl)-, 1,1-dimethylethyl ester
CAS Number: 89631-75-4
Product Number: AG003STH(AGN-PC-0JUYO0)
Synonyms:
MDL No:
Molecular Formula: C12H14N2O2S
Molecular Weight: 250.31676

Identification/Properties


Computed Properties
Molecular Weight:
250.316g/mol
XLogP3:
3.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
250.078g/mol
Monoisotopic Mass:
250.078g/mol
Topological Polar Surface Area:
82.8A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
311
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


NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback