Home Nitriles 3-[(oxolan-3-ylmethyl)amino]propanenitrile

3-[(oxolan-3-ylmethyl)amino]propanenitrile

CAS No.:
184888-17-3
Catalog Number:
AG01AAUU
Molecular Formula:
C8H14N2O
Molecular Weight:
154.2096
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Product Description
Catalog Number:
AG01AAUU
Chemical Name:
3-[(oxolan-3-ylmethyl)amino]propanenitrile
CAS Number:
184888-17-3
Molecular Formula:
C8H14N2O
Molecular Weight:
154.2096
MDL Number:
MFCD11166752
IUPAC Name:
3-(oxolan-3-ylmethylamino)propanenitrile
InChI:
InChI=1S/C8H14N2O/c9-3-1-4-10-6-8-2-5-11-7-8/h8,10H,1-2,4-7H2
InChI Key:
XOIIMBMFUNMUTA-UHFFFAOYSA-N
SMILES:
N#CCCNCC1COCC1
Properties
Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.111g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
154.213g/mol
Monoisotopic Mass:
154.111g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
45A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties