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Home > Imidazoles > 139959-97-0
139959-97-0 | Morpholine, 4-[(4-methyl-1H-imidazol-5-yl)methyl]-
CAS No: 139959-97-0 Catalog No: AG001BVG MDL No:
Product Description
Catalog Number:
AG001BVG
Chemical Name:
Morpholine, 4-[(4-methyl-1H-imidazol-5-yl)methyl]-
CAS Number:
139959-97-0
Molecular Formula:
C9H15N3O
Molecular Weight:
181.2349
IUPAC Name:
4-[(5-methyl-1H-imidazol-4-yl)methyl]morpholine
InChI:
InChI=1S/C9H15N3O/c1-8-9(11-7-10-8)6-12-2-4-13-5-3-12/h7H,2-6H2,1H3,(H,10,11)
InChI Key:
PPWIQMPCJPFEFN-UHFFFAOYSA-N
SMILES:
Cc1nc[nH]c1CN1CCOCC1
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.122g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.239g/mol
Monoisotopic Mass:
181.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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