Home Nitriles 1-(2-hydroxyethyl)-3-methyl-1H-pyrazole-4-carbonitrile

1-(2-hydroxyethyl)-3-methyl-1H-pyrazole-4-carbonitrile

CAS No.:
1849407-91-5
Catalog Number:
AG01DZ4O
Molecular Formula:
C7H9N3O
Molecular Weight:
151.1659
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Product Description
Catalog Number:
AG01DZ4O
Chemical Name:
1-(2-hydroxyethyl)-3-methyl-1H-pyrazole-4-carbonitrile
CAS Number:
1849407-91-5
Molecular Formula:
C7H9N3O
Molecular Weight:
151.1659
MDL Number:
MFCD31559761
IUPAC Name:
1-(2-hydroxyethyl)-3-methylpyrazole-4-carbonitrile
InChI:
InChI=1S/C7H9N3O/c1-6-7(4-8)5-10(9-6)2-3-11/h5,11H,2-3H2,1H3
InChI Key:
JHAVGSJOKWLAOV-UHFFFAOYSA-N
SMILES:
OCCn1nc(c(c1)C#N)C
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.075g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
151.169g/mol
Monoisotopic Mass:
151.075g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties