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ethyl 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)sulfanyl]dodecanoate

ethyl 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)sulfanyl]dodecanoate structure

CAS No:
87202-59-3
Formula:
C17H29N3O4S
Chemical Name:
ethyl 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)sulfanyl]dodecanoate
Synonyms:
NSC319619;87202-59-3;DTXSID00317640;NSC-319619;2-[[(3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazine)-6-yl]thio]dodecanoic acid ethyl ester

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ethyl 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)sulfanyl]dodecanoate Basic Attributes

Molecular Weight：

371.5 g/mol

Exact Mass：

371.18787759 g/mol

NSC Number：

319619

DSSTox ID：

DTXSID00317640

Characteristics

PSA：

122 Å²

Computed Properties

Molecular Weight:371.5
XLogP3:5.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:14
Exact Mass:371.18787759
Monoisotopic Mass:371.18787759
Topological Polar Surface Area:122
Heavy Atom Count:25
Complexity:483
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)sulfanyl]dodecanoate

Basic Attributes
Characteristics
Computed Properties
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