Home Nitriles 2-(furan-2-ylmethyl)-3-hydroxypropanenitrile

2-(furan-2-ylmethyl)-3-hydroxypropanenitrile

CAS No.:
929973-81-9
Catalog Number:
AG019KKX
Molecular Formula:
C8H9NO2
Molecular Weight:
151.1626
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Product Description
Catalog Number:
AG019KKX
Chemical Name:
2-(furan-2-ylmethyl)-3-hydroxypropanenitrile
CAS Number:
929973-81-9
Molecular Formula:
C8H9NO2
Molecular Weight:
151.1626
MDL Number:
MFCD09040589
IUPAC Name:
2-(furan-2-ylmethyl)-3-hydroxypropanenitrile
InChI:
InChI=1S/C8H9NO2/c9-5-7(6-10)4-8-2-1-3-11-8/h1-3,7,10H,4,6H2
InChI Key:
JXCHQORAJGXTOX-UHFFFAOYSA-N
SMILES:
OCC(Cc1ccco1)C#N
Properties
Complexity:
161  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.063g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
151.165g/mol
Monoisotopic Mass:
151.063g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties