(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-chloro-5-methylsulfanylbenzoate
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(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-chloro-5-methylsulfanylbenzoate
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CAS No:
561027-39-2
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Formula:
C17H14ClNO6S
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Chemical Name:
(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-chloro-5-methylsulfanylbenzoate
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Synonyms:
ZINC2660314;AKOS033625870;MCULE-5354513199;AB00724927-01;Z18492465;(6-nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloro-5-(methylsulfanyl)benzoate;561027-39-2
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CAS No:
(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-chloro-5-methylsulfanylbenzoate Basic Attributes
395.8 g/mol
395.0230360 g/mol
Computed Properties
Molecular Weight:395.8
XLogP3:3.7
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:395.0230360
Monoisotopic Mass:395.0230360
Topological Polar Surface Area:116
Heavy Atom Count:26
Complexity:518
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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