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Home > Other Heterocycles > 70383-86-7
70383-86-7 | Morpholine,4-(3'-methyl-2,2'-spirobi[2H-1-benzopyran]-7-yl)-
CAS No: 70383-86-7 Catalog No: AG0069CX MDL No:
Product Description
Catalog Number:
AG0069CX
Chemical Name:
Morpholine,4-(3'-methyl-2,2'-spirobi[2H-1-benzopyran]-7-yl)-
CAS Number:
70383-86-7
Molecular Formula:
C22H21NO3
Molecular Weight:
347.4070
IUPAC Name:
4-(3'-methyl-2,2'-spirobi[chromene]-7-yl)morpholine
InChI:
InChI=1S/C22H21NO3/c1-16-14-18-4-2-3-5-20(18)25-22(16)9-8-17-6-7-19(15-21(17)26-22)23-10-12-24-13-11-23/h2-9,14-15H,10-13H2,1H3
InChI Key:
XVHYHEGAGVGQJD-UHFFFAOYSA-N
SMILES:
CC1=Cc2ccccc2OC21C=Cc1c(O2)cc(cc1)N1CCOCC1
EC Number:
274-587-9
Properties
Complexity:
582
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.152g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
347.414g/mol
Monoisotopic Mass:
347.152g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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