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Home > Other Heterocycles > 88151-82-0
88151-82-0 | 2-Butanone, 4-(11-phenyl-8-azaspiro[5.6]dodec-8-yl)-, hydrochloride
CAS No: 88151-82-0 Catalog No: AG004ECA MDL No:
Product Description
Catalog Number:
AG004ECA
Chemical Name:
2-Butanone, 4-(11-phenyl-8-azaspiro[5.6]dodec-8-yl)-, hydrochloride
CAS Number:
88151-82-0
Molecular Formula:
C21H32ClNO
Molecular Weight:
349.9379
IUPAC Name:
4-(11-phenyl-8-azaspiro[5.6]dodecan-8-yl)butan-2-one;hydrochloride
InChI:
InChI=1S/C21H31NO.ClH/c1-18(23)10-14-22-15-11-20(19-8-4-2-5-9-19)16-21(17-22)12-6-3-7-13-21;/h2,4-5,8-9,20H,3,6-7,10-17H2,1H3;1H
InChI Key:
RYWCZWHKJRNPRY-UHFFFAOYSA-N
SMILES:
CC(=O)CCN1CCC(CC2(C1)CCCCC2)c1ccccc1.Cl
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.217g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
349.943g/mol
Monoisotopic Mass:
349.217g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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