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Home > Other Heterocycles > 1779128-19-6
1779128-19-6 | 6-Methyl-3H-spiro[2-benzofuran-1,4'-piperidine] hydrochloride
CAS No: 1779128-19-6 Catalog No: AG01F6JL MDL No:
Product Description
Catalog Number:
AG01F6JL
Chemical Name:
6-Methyl-3H-spiro[2-benzofuran-1,4'-piperidine] hydrochloride
CAS Number:
1779128-19-6
Molecular Formula:
C13H18ClNO
Molecular Weight:
239.7411
IUPAC Name:
5-methylspiro[1H-2-benzofuran-3,4'-piperidine];hydrochloride
InChI:
InChI=1S/C13H17NO.ClH/c1-10-2-3-11-9-15-13(12(11)8-10)4-6-14-7-5-13;/h2-3,8,14H,4-7,9H2,1H3;1H
InChI Key:
AOMWDSIZJPJPHG-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)C1(CCNCC1)OC2.Cl
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.108g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
239.743g/mol
Monoisotopic Mass:
239.108g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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