CAS
24077-98-3 Purity
96%
24077-98-3 Purity
96%
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Diethyl stilbestrol beta-D-glucuronide
CAS
2408-40-4
Catalog Number
ACM2408404
Category
Other Products
Molecular Weight
444.47
Molecular Formula
C24H28O8
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Specification
Synonyms
Diethylstilbestrol glucuronide, Diethylstilbestrol monoglucuronide, EINECS 219-310-4, CID3036236, (E)-4-(1-Ethyl-2-(4-hydroxyphenyl)but-1-enyl)phenyl-beta-D-glucopyranosiduronic acid, 2408-40-4
IUPAC Name
(2S,3S,4S,5R)-3,4,5-trihydroxy-6-[4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenoxy]oxane-2-carboxylic acid
Canonical SMILES
CCC(=C(CC)C1=CC=C(C=C1)OC2C(C(C(C(O2)C(=O)O)O)O)O)C3=CC=C(C=C3)O
InChI Key
LJMPVHCKUXKZAV-YTXXKCOASA-N
Boiling Point
683.5ºC at 760mmHg
Melting Point
136-138ºC
Flash Point
233.5ºC
Density
1.369g/cm³
EC Number
219-310-4
Exact Mass
444.17800
H-Bond Acceptor
8
H-Bond Donor
5
Packing Group
III
Safety Description
53-22-26-36/37/39-45
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