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53813-00-6 | 2-(morpholin-4-yl)-2-(pyridin-2-yl)acetonitrile
CAS No: 53813-00-6 Catalog No: AG00IQ1W MDL No:MFCD00231856
Product Description
Catalog Number:
AG00IQ1W
Chemical Name:
2-(morpholin-4-yl)-2-(pyridin-2-yl)acetonitrile
CAS Number:
53813-00-6
Molecular Formula:
C11H13N3O
Molecular Weight:
203.2404
MDL Number:
MFCD00231856
IUPAC Name:
2-morpholin-4-yl-2-pyridin-2-ylacetonitrile
InChI:
InChI=1S/C11H13N3O/c12-9-11(10-3-1-2-4-13-10)14-5-7-15-8-6-14/h1-4,11H,5-8H2
InChI Key:
OJMXBAFOIQQMMJ-UHFFFAOYSA-N
SMILES:
N#CC(c1ccccn1)N1CCOCC1
NSC Number:
208416
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.245g/mol
Monoisotopic Mass:
203.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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