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84163-12-2 | 3-(1-Methyl-4-piperidinyl)-1,2-benzisoxazole Hydrochloride
CAS No: 84163-12-2 Catalog No: AG00G52M MDL No:
Product Description
Catalog Number:
AG00G52M
Chemical Name:
3-(1-Methyl-4-piperidinyl)-1,2-benzisoxazole Hydrochloride
CAS Number:
84163-12-2
IUPAC Name:
3-(1-methylpiperidin-4-yl)-1,2-benzoxazole;hydrochloride
InChI:
InChI=1S/C13H16N2O.ClH/c1-15-8-6-10(7-9-15)13-11-4-2-3-5-12(11)16-14-13;/h2-5,10H,6-9H2,1H3;1H
InChI Key:
VQWDHKXDNJREDM-UHFFFAOYSA-N
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.103g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
252.742g/mol
Monoisotopic Mass:
252.103g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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