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52426-69-4 | 3-Pyridineacetonitrile, 6-(hydroxymethyl)- (9CI)
CAS No: 52426-69-4 Catalog No: AG00E2I1 MDL No:
Product Description
Catalog Number:
AG00E2I1
Chemical Name:
3-Pyridineacetonitrile, 6-(hydroxymethyl)- (9CI)
CAS Number:
52426-69-4
IUPAC Name:
2-[6-(hydroxymethyl)pyridin-3-yl]acetonitrile
InChI:
InChI=1S/C8H8N2O/c9-4-3-7-1-2-8(6-11)10-5-7/h1-2,5,11H,3,6H2
InChI Key:
SXOUAYJWHJCHQK-UHFFFAOYSA-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:
148.064g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
148.165g/mol
Monoisotopic Mass:
148.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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