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Home > Other Heterocycles > 1363165-92-7
1363165-92-7 | Spiro[cyclobutane-1,2'(1'H)-quinazolin]-4'(3'H)-one
CAS No: 1363165-92-7 Catalog No: AG0011LS MDL No:MFCD21641327
Product Description
Catalog Number:
AG0011LS
Chemical Name:
Spiro[cyclobutane-1,2'(1'H)-quinazolin]-4'(3'H)-one
CAS Number:
1363165-92-7
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
MDL Number:
MFCD21641327
IUPAC Name:
spiro[1,3-dihydroquinazoline-2,1'-cyclobutane]-4-one
InChI:
InChI=1S/C11H12N2O/c14-10-8-4-1-2-5-9(8)12-11(13-10)6-3-7-11/h1-2,4-5,12H,3,6-7H2,(H,13,14)
InChI Key:
DGMNNVUFBRHTBC-UHFFFAOYSA-N
SMILES:
O=C1NC2(CCC2)Nc2c1cccc2
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
188.23g/mol
Monoisotopic Mass:
188.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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