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92178-79-5 | Urea, N-formyl-N-methyl-N'-[3-(1-methylethyl)-5-isoxazolyl]-
CAS No: 92178-79-5 Catalog No: AG006GK6 MDL No:
Product Description
Catalog Number:
AG006GK6
Chemical Name:
Urea, N-formyl-N-methyl-N'-[3-(1-methylethyl)-5-isoxazolyl]-
CAS Number:
92178-79-5
Molecular Formula:
C9H13N3O3
Molecular Weight:
211.2178
IUPAC Name:
N-methyl-N-[(3-propan-2-yl-1,2-oxazol-5-yl)carbamoyl]formamide
InChI:
InChI=1S/C9H13N3O3/c1-6(2)7-4-8(15-11-7)10-9(14)12(3)5-13/h4-6H,1-3H3,(H,10,14)
InChI Key:
ZTOFRGFPUITMAJ-UHFFFAOYSA-N
SMILES:
O=CN(C(=O)Nc1onc(c1)C(C)C)C
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.096g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.221g/mol
Monoisotopic Mass:
211.096g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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