200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 919748-91-7
919748-91-7 | 4',6',7',8',9',10'-hexahydro-3'H-1',11'-dioxaspiro[cyclohexane-1,2'-tetraphene]-10'-thione
CAS No: 919748-91-7 Catalog No: AG01B5XQ MDL No:MFCD08746625
Product Description
Catalog Number:
AG01B5XQ
Chemical Name:
4',6',7',8',9',10'-hexahydro-3'H-1',11'-dioxaspiro[cyclohexane-1,2'-tetraphene]-10'-thione
CAS Number:
919748-91-7
Molecular Formula:
C21H24O2S
Molecular Weight:
340.4791
MDL Number:
MFCD08746625
IUPAC Name:
spiro[1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromene-9,1'-cyclohexane]-5-thione
InChI:
InChI=1S/C21H24O2S/c24-20-16-7-3-2-6-15(16)17-12-14-8-11-21(9-4-1-5-10-21)23-18(14)13-19(17)22-20/h12-13H,1-11H2
InChI Key:
SRCZDDLLKBJZNP-UHFFFAOYSA-N
SMILES:
S=c1oc2cc3OC4(CCCCC4)CCc3cc2c2c1CCCC2
Properties
Complexity:
560
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.15g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
340.481g/mol
Monoisotopic Mass:
340.15g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.