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27144-54-3 | 3-Isoxazolecarboxamide,N,5-dimethyl-(6CI,8CI,9CI)
CAS No: 27144-54-3 Catalog No: AG00BUY8 MDL No:MFCD19159614
Product Description
Catalog Number:
AG00BUY8
Chemical Name:
3-Isoxazolecarboxamide,N,5-dimethyl-(6CI,8CI,9CI)
CAS Number:
27144-54-3
Molecular Formula:
C6H8N2O2
Molecular Weight:
140.1399
MDL Number:
MFCD19159614
IUPAC Name:
N,5-dimethyl-1,2-oxazole-3-carboxamide
InChI:
InChI=1S/C6H8N2O2/c1-4-3-5(8-10-4)6(9)7-2/h3H,1-2H3,(H,7,9)
InChI Key:
UADBLWJCRFUFRY-UHFFFAOYSA-N
SMILES:
CNC(=O)c1noc(c1)C
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.059g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
140.142g/mol
Monoisotopic Mass:
140.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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