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Home > Other Heterocycles > 898782-04-2
898782-04-2 | ETHYL 4-[4-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]PHENYL]-4-OXOBUTYRATE
CAS No: 898782-04-2 Catalog No: AG00GXY4 MDL No:
Product Description
Catalog Number:
AG00GXY4
Chemical Name:
ETHYL 4-[4-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]PHENYL]-4-OXOBUTYRATE
CAS Number:
898782-04-2
IUPAC Name:
ethyl 4-[4-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylmethyl)phenyl]-4-oxobutanoate
InChI:
InChI=1S/C20H27NO5/c1-2-24-19(23)8-7-18(22)17-5-3-16(4-6-17)15-21-11-9-20(10-12-21)25-13-14-26-20/h3-6H,2,7-15H2,1H3
InChI Key:
GRKHPCGGQOZDEV-UHFFFAOYSA-N
Properties
Complexity:
471
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.189g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
361.438g/mol
Monoisotopic Mass:
361.189g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
65.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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