Home Nitriles 2-hydroxy-3-methoxypropanenitrile

2-hydroxy-3-methoxypropanenitrile

CAS No.:
93177-83-4
Catalog Number:
AG01B7FU
Molecular Formula:
C4H7NO2
Molecular Weight:
101.1039
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Product Description
Catalog Number:
AG01B7FU
Chemical Name:
2-hydroxy-3-methoxypropanenitrile
CAS Number:
93177-83-4
Molecular Formula:
C4H7NO2
Molecular Weight:
101.1039
MDL Number:
MFCD29983716
IUPAC Name:
2-hydroxy-3-methoxypropanenitrile
InChI:
InChI=1S/C4H7NO2/c1-7-3-4(6)2-5/h4,6H,3H2,1H3
InChI Key:
ZTGYDHMYFQUFMT-UHFFFAOYSA-N
SMILES:
COCC(C#N)O
Properties
Complexity:
82.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
101.048g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
101.105g/mol
Monoisotopic Mass:
101.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties