Home Nitriles 2-(oxan-4-yl)prop-2-enenitrile

2-(oxan-4-yl)prop-2-enenitrile

CAS No.:
1895732-44-1
Catalog Number:
AG01EM89
Molecular Formula:
C8H11NO
Molecular Weight:
137.1790
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Product Description
Catalog Number:
AG01EM89
Chemical Name:
2-(oxan-4-yl)prop-2-enenitrile
CAS Number:
1895732-44-1
Molecular Formula:
C8H11NO
Molecular Weight:
137.1790
MDL Number:
MFCD31559722
IUPAC Name:
2-(oxan-4-yl)prop-2-enenitrile
InChI:
InChI=1S/C8H11NO/c1-7(6-9)8-2-4-10-5-3-8/h8H,1-5H2
InChI Key:
LXQCROVTYBCURP-UHFFFAOYSA-N
SMILES:
N#CC(=C)C1CCOCC1
Properties
Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.084g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
137.182g/mol
Monoisotopic Mass:
137.084g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties