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1221792-37-5 | 3,4-dihydro-1H-spiro[naphthalene-2,2'-[1,3]thiazolidine]-4'-one
CAS No: 1221792-37-5 Catalog No: AG00IRMR MDL No:MFCD16140281
Product Description
Catalog Number:
AG00IRMR
Chemical Name:
3,4-dihydro-1H-spiro[naphthalene-2,2'-[1,3]thiazolidine]-4'-one
CAS Number:
1221792-37-5
Molecular Formula:
C12H13NOS
Molecular Weight:
219.3027
MDL Number:
MFCD16140281
IUPAC Name:
spiro[1,3-thiazolidine-2,3'-2,4-dihydro-1H-naphthalene]-4-one
InChI:
InChI=1S/C12H13NOS/c14-11-8-15-12(13-11)6-5-9-3-1-2-4-10(9)7-12/h1-4H,5-8H2,(H,13,14)
InChI Key:
OMHBHFDVHZBHJP-UHFFFAOYSA-N
SMILES:
O=C1CSC2(N1)CCc1c(C2)cccc1
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.072g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.302g/mol
Monoisotopic Mass:
219.072g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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