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Home > Other Heterocycles > 93467-42-6
93467-42-6 | 6-methyl-3,4-dihydrospiro[1-benzopyran-2,1'-cyclopentane]-4-one
CAS No: 93467-42-6 Catalog No: AG01BOWJ MDL No:MFCD30499662
Product Description
Catalog Number:
AG01BOWJ
Chemical Name:
6-methyl-3,4-dihydrospiro[1-benzopyran-2,1'-cyclopentane]-4-one
CAS Number:
93467-42-6
Molecular Formula:
C14H16O2
Molecular Weight:
216.2756
MDL Number:
MFCD30499662
IUPAC Name:
6-methylspiro[3H-chromene-2,1'-cyclopentane]-4-one
InChI:
InChI=1S/C14H16O2/c1-10-4-5-13-11(8-10)12(15)9-14(16-13)6-2-3-7-14/h4-5,8H,2-3,6-7,9H2,1H3
InChI Key:
WRQCILORQGBFSO-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)C(=O)CC1(O2)CCCC1
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.115g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.28g/mol
Monoisotopic Mass:
216.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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