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99980-24-2 | UREA, (3,4-DIMETHYL-5-ISOXAZOLYL)-
CAS No: 99980-24-2 Catalog No: AG003VI7 MDL No:
Product Description
Catalog Number:
AG003VI7
Chemical Name:
UREA, (3,4-DIMETHYL-5-ISOXAZOLYL)-
CAS Number:
99980-24-2
Molecular Formula:
C6H9N3O2
Molecular Weight:
155.1546
IUPAC Name:
(3,4-dimethyl-1,2-oxazol-5-yl)urea
InChI:
InChI=1S/C6H9N3O2/c1-3-4(2)9-11-5(3)8-6(7)10/h1-2H3,(H3,7,8,10)
InChI Key:
PIJAZECBFDYUPN-UHFFFAOYSA-N
SMILES:
Cc1c(NC(=O)N)onc1C
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.069g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
155.157g/mol
Monoisotopic Mass:
155.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
81.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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