Home Nitriles 2-Hydroxypropenenitrile

2-Hydroxypropenenitrile

CAS No.:
5809-59-6
Catalog Number:
AG00EYG8
Molecular Formula:
C4H5NO
Molecular Weight:
83.0886
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Product Description
Catalog Number:
AG00EYG8
Chemical Name:
2-Hydroxypropenenitrile
CAS Number:
5809-59-6
Molecular Formula:
C4H5NO
Molecular Weight:
83.0886
MDL Number:
MFCD01656473
IUPAC Name:
2-hydroxybut-3-enenitrile
InChI:
InChI=1S/C4H5NO/c1-2-4(6)3-5/h2,4,6H,1H2
InChI Key:
WKFMHXZXCCJSJK-UHFFFAOYSA-N
SMILES:
OC(C#N)C=C
EC Number:
227-371-3
Properties
Complexity:
89  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
83.037g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
83.09g/mol
Monoisotopic Mass:
83.037g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Literature
Title Journal
Characterisation of the substrate specificity of the nitrile hydrolyzing system of the acidotolerant black yeast Exophiala oligosperma R1. Studies in mycology 20080101
Fumigation toxicity of volatile natural and synthetic cyanohydrins to stored-product pests and activity as soil fumigants. Pest management science 20040801
Properties