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Home > Other Heterocycles > 898762-61-3
898762-61-3 | ETHYL 5-[3-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]PHENYL]-5-OXOVALERATE
CAS No: 898762-61-3 Catalog No: AG00GXK7 MDL No:
Product Description
Catalog Number:
AG00GXK7
Chemical Name:
ETHYL 5-[3-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]PHENYL]-5-OXOVALERATE
CAS Number:
898762-61-3
IUPAC Name:
ethyl 5-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylmethyl)phenyl]-5-oxopentanoate
InChI:
InChI=1S/C21H29NO5/c1-2-25-20(24)8-4-7-19(23)18-6-3-5-17(15-18)16-22-11-9-21(10-12-22)26-13-14-27-21/h3,5-6,15H,2,4,7-14,16H2,1H3
InChI Key:
XJRNKEIYSNRCBI-UHFFFAOYSA-N
Properties
Complexity:
493
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
375.205g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
375.465g/mol
Monoisotopic Mass:
375.205g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
65.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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