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37071-01-5 | 3-Isoxazolecarbonylisocyanate,5-methyl-(9CI)
CAS No: 37071-01-5 Catalog No: AG00CZ4W MDL No:
Product Description
Catalog Number:
AG00CZ4W
Chemical Name:
3-Isoxazolecarbonylisocyanate,5-methyl-(9CI)
CAS Number:
37071-01-5
IUPAC Name:
5-methyl-1,2-oxazole-3-carbonyl isocyanate
InChI:
InChI=1S/C6H4N2O3/c1-4-2-5(8-11-4)6(10)7-3-9/h2H,1H3
InChI Key:
DKFRLFXSPOEWOT-UHFFFAOYSA-N
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.022g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.109g/mol
Monoisotopic Mass:
152.022g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
72.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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