Ethane, 1-isothiocyanato-2-methoxy-


Chemical Name: Ethane, 1-isothiocyanato-2-methoxy-
CAS Number: 38663-85-3
Product Number: AG003HK6(AGN-PC-0JLOGY)
Synonyms:
MDL No:
Molecular Formula: C4H7NOS
Molecular Weight: 117.1695

Identification/Properties


Properties
Storage:
2-8℃;Inert atmosphere;
Computed Properties
Molecular Weight:
117.166g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
117.025g/mol
Monoisotopic Mass:
117.025g/mol
Topological Polar Surface Area:
53.7A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
77.8
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#:
1992
Hazard Statements:
H225-H301-H312+H332-H315-H319-H335
Precautionary Statements:
P210-P280-P301+P310+P330-P302+P352+P312-P304+P340+P312-P305+P351+P338
Class:
3,6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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