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52535-35-0 | 2-Methyl-4-(6-methyl-3-pyridyl)-3-butyn-2-ol
CAS No: 52535-35-0 Catalog No: AG00E2NB MDL No:
Product Description
Catalog Number:
AG00E2NB
Chemical Name:
2-Methyl-4-(6-methyl-3-pyridyl)-3-butyn-2-ol
CAS Number:
52535-35-0
IUPAC Name:
2-methyl-4-(6-methylpyridin-3-yl)but-3-yn-2-ol
InChI:
InChI=1S/C11H13NO/c1-9-4-5-10(8-12-9)6-7-11(2,3)13/h4-5,8,13H,1-3H3
InChI Key:
KJJAFWJUOBJLAZ-UHFFFAOYSA-N
UNII:
JP42VDV0WD
NSC Number:
220264
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.1g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.231g/mol
Monoisotopic Mass:
175.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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