5-Fluorospiro[1,2,3,4-tetrahydroquinazoline-2,1'-cyclopentane]-4-one - CAS 1272756-06-5
Catalog: |
BB006761 |
Product Name: |
5-Fluorospiro[1,2,3,4-tetrahydroquinazoline-2,1'-cyclopentane]-4-one |
CAS: |
1272756-06-5 |
Synonyms: |
5-fluoro-4-spiro[1,3-dihydroquinazoline-2,1'-cyclopentane]one; 5-fluorospiro[1,3-dihydroquinazoline-2,1'-cyclopentane]-4-one |
IUPAC Name: | 5-fluorospiro[1,3-dihydroquinazoline-2,1'-cyclopentane]-4-one |
Description: | 5-Fluorospiro[1,2,3,4-tetrahydroquinazoline-2,1'-cyclopentane]-4-one (CAS# 1272756-06-5 ) is a useful research chemical. |
Molecular Weight: | 220.24 |
Molecular Formula: | C12H13FN2O |
Canonical SMILES: | C1CCC2(C1)NC3=C(C(=CC=C3)F)C(=O)N2 |
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 |
LogP: | 2.39970 |
Complexity: | 301 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 220.1011912 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 220.1011912 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 41.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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