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Home > Fluorides > 1272756-06-5
1272756-06-5 | Spiro[cyclopentane-1,2'(1'H)-quinazolin]-4'(3'H)-one, 5'-fluoro-
CAS No: 1272756-06-5 Catalog No: AG000WV9 MDL No:MFCD18651732
Product Description
Catalog Number:
AG000WV9
Chemical Name:
Spiro[cyclopentane-1,2'(1'H)-quinazolin]-4'(3'H)-one, 5'-fluoro-
CAS Number:
1272756-06-5
Molecular Formula:
C12H13FN2O
Molecular Weight:
220.2428
MDL Number:
MFCD18651732
IUPAC Name:
5-fluorospiro[1,3-dihydroquinazoline-2,1'-cyclopentane]-4-one
InChI:
InChI=1S/C12H13FN2O/c13-8-4-3-5-9-10(8)11(16)15-12(14-9)6-1-2-7-12/h3-5,14H,1-2,6-7H2,(H,15,16)
InChI Key:
WZCWYEGVBLSJGM-UHFFFAOYSA-N
SMILES:
O=C1NC2(CCCC2)Nc2c1c(F)ccc2
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.101g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.247g/mol
Monoisotopic Mass:
220.101g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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