Benzene, 4-chloro-2-isocyanato-1-methoxy-


Chemical Name: Benzene, 4-chloro-2-isocyanato-1-methoxy-
CAS Number: 55440-54-5
Product Number: AG003MN7(AGN-PC-0JMTMI)
Synonyms:
MDL No:
Molecular Formula: C8H6ClNO2
Molecular Weight: 183.5917

Identification/Properties


Properties
MP:
58-61℃(lit.)
Form:
Solid
Computed Properties
Molecular Weight:
183.591g/mol
XLogP3:
3.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
183.009g/mol
Monoisotopic Mass:
183.009g/mol
Topological Polar Surface Area:
38.7A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
192
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

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NMR Spectrum


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