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Home > Bromides > 1272756-17-8
1272756-17-8 | Spiro[cyclopentane-1,2'(1'H)-quinazolin]-4'(3'H)-one, 6'-bromo-
CAS No: 1272756-17-8 Catalog No: AG000WUY MDL No:MFCD18651733
Product Description
Catalog Number:
AG000WUY
Chemical Name:
Spiro[cyclopentane-1,2'(1'H)-quinazolin]-4'(3'H)-one, 6'-bromo-
CAS Number:
1272756-17-8
Molecular Formula:
C12H13BrN2O
Molecular Weight:
281.1484
MDL Number:
MFCD18651733
IUPAC Name:
6-bromospiro[1,3-dihydroquinazoline-2,1'-cyclopentane]-4-one
InChI:
InChI=1S/C12H13BrN2O/c13-8-3-4-10-9(7-8)11(16)15-12(14-10)5-1-2-6-12/h3-4,7,14H,1-2,5-6H2,(H,15,16)
InChI Key:
DZVKUMGRDZGAIN-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)C(=O)NC1(N2)CCCC1
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.021g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
281.153g/mol
Monoisotopic Mass:
280.021g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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