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Home > Other Heterocycles > 1598841-93-0
1598841-93-0 | 3,4-dihydrospiro[1-benzopyran-2,3'-oxolane]-4-one
CAS No: 1598841-93-0 Catalog No: AG01BOVP MDL No:MFCD30499635
Product Description
Catalog Number:
AG01BOVP
Chemical Name:
3,4-dihydrospiro[1-benzopyran-2,3'-oxolane]-4-one
CAS Number:
1598841-93-0
Molecular Formula:
C12H12O3
Molecular Weight:
204.2219
MDL Number:
MFCD30499635
IUPAC Name:
spiro[3H-chromene-2,3'-oxolane]-4-one
InChI:
InChI=1S/C12H12O3/c13-10-7-12(5-6-14-8-12)15-11-4-2-1-3-9(10)11/h1-4H,5-8H2
InChI Key:
RUZJKBFLNATYGP-UHFFFAOYSA-N
SMILES:
O=C1CC2(COCC2)Oc2c1cccc2
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.225g/mol
Monoisotopic Mass:
204.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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