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36641-23-3 | 2-methyl-5-(morpholin-4-yl)-1,3-oxazole-4-carbonitrile
CAS No: 36641-23-3 Catalog No: AG01B1H3 MDL No:MFCD00462456
Product Description
Catalog Number:
AG01B1H3
Chemical Name:
2-methyl-5-(morpholin-4-yl)-1,3-oxazole-4-carbonitrile
CAS Number:
36641-23-3
Molecular Formula:
C9H11N3O2
Molecular Weight:
193.2025
MDL Number:
MFCD00462456
IUPAC Name:
2-methyl-5-morpholin-4-yl-1,3-oxazole-4-carbonitrile
InChI:
InChI=1S/C9H11N3O2/c1-7-11-8(6-10)9(14-7)12-2-4-13-5-3-12/h2-5H2,1H3
InChI Key:
WELMHJIYMANPRN-UHFFFAOYSA-N
SMILES:
N#Cc1nc(oc1N1CCOCC1)C
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.085g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.206g/mol
Monoisotopic Mass:
193.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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