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83823-51-2 | Morpholine,4-(3,4-dihydro-2H-1-benzopyran-3-yl)-
CAS No: 83823-51-2 Catalog No: AG004S6J MDL No:
Product Description
Catalog Number:
AG004S6J
Chemical Name:
Morpholine,4-(3,4-dihydro-2H-1-benzopyran-3-yl)-
CAS Number:
83823-51-2
Molecular Formula:
C13H17NO2
Molecular Weight:
219.2796
IUPAC Name:
4-(3,4-dihydro-2H-chromen-3-yl)morpholine
InChI:
InChI=1S/C13H17NO2/c1-2-4-13-11(3-1)9-12(10-16-13)14-5-7-15-8-6-14/h1-4,12H,5-10H2
InChI Key:
KCUOCZMIUOXXQT-UHFFFAOYSA-N
SMILES:
O1CCN(CC1)C1COc2c(C1)cccc2
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.126g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.284g/mol
Monoisotopic Mass:
219.126g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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