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Home > Other Heterocycles > 1330764-30-1
1330764-30-1 | 1,2-dihydrospiro[benzo[c]azepine-4,4'-piperidin]-3(5H)-one
CAS No: 1330764-30-1 Catalog No: AG01DKEO MDL No:
Product Description
Catalog Number:
AG01DKEO
Chemical Name:
1,2-dihydrospiro[benzo[c]azepine-4,4'-piperidin]-3(5H)-one
CAS Number:
1330764-30-1
Molecular Formula:
C14H18N2O
Molecular Weight:
230.3055
IUPAC Name:
spiro[2,5-dihydro-1H-2-benzazepine-4,4'-piperidine]-3-one
InChI:
InChI=1S/C14H18N2O/c17-13-14(5-7-15-8-6-14)9-11-3-1-2-4-12(11)10-16-13/h1-4,15H,5-10H2,(H,16,17)
InChI Key:
MXZLUMHZBQEKKN-UHFFFAOYSA-N
SMILES:
O=C1NCc2c(CC31CCNCC3)cccc2
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.142g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
230.311g/mol
Monoisotopic Mass:
230.142g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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