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63071-10-3 | (4-Chloropyridine-2-yl)methanol
CAS No: 63071-10-3 Catalog No: AG003BVG MDL No:MFCD07437885
Product Description
Catalog Number:
AG003BVG
Chemical Name:
(4-Chloropyridine-2-yl)methanol
CAS Number:
63071-10-3
Molecular Formula:
C6H6ClNO
Molecular Weight:
143.5709
MDL Number:
MFCD07437885
IUPAC Name:
(4-chloropyridin-2-yl)methanol
InChI:
InChI=1S/C6H6ClNO/c7-5-1-2-8-6(3-5)4-9/h1-3,9H,4H2
InChI Key:
UEAIOHHGRGSGGJ-UHFFFAOYSA-N
SMILES:
OCc1cc(Cl)ccn1
Properties
Complexity:
89.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.014g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
143.57g/mol
Monoisotopic Mass:
143.014g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
Literature
| Title | Journal |
|---|---|
| On the mechanism of dimethylarginine dimethylaminohydrolase inactivation by 4-halopyridines. | Journal of the American Chemical Society 20110720 |
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