Benzene, 1-chloro-3-isocyanato-


Chemical Name: Benzene, 1-chloro-3-isocyanato-
CAS Number: 2909-38-8
Product Number: AG0033OF(AGN-PC-0JKDSF)
Synonyms:
MDL No:
Molecular Formula: C7H4ClNO
Molecular Weight: 153.5658

Identification/Properties


Properties
MP:
−4 °C(lit.)
BP:
113-114 °C43 mm Hg(lit.)
Storage:
2-8℃;Keep in dry area;
Form:
Liquid
Stability:
Moisture Sensitive
Refractive Index:
n20/D 1.559(lit.)
Solubility:
Decomposes
Computed Properties
Molecular Weight:
153.565g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
152.998g/mol
Monoisotopic Mass:
152.998g/mol
Topological Polar Surface Area:
29.4A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
154
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


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