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80033-09-6 | 3-Butyn-2-ol, 4-(2-pyridinyl)- (9CI)
CAS No: 80033-09-6 Catalog No: AG00GOHV MDL No:
Product Description
Catalog Number:
AG00GOHV
Chemical Name:
3-Butyn-2-ol, 4-(2-pyridinyl)- (9CI)
CAS Number:
80033-09-6
IUPAC Name:
4-pyridin-2-ylbut-3-yn-2-ol
InChI:
InChI=1S/C9H9NO/c1-8(11)5-6-9-4-2-3-7-10-9/h2-4,7-8,11H,1H3
InChI Key:
YDCZRHRXMVIFNH-UHFFFAOYSA-N
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.068g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
147.177g/mol
Monoisotopic Mass:
147.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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