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ethyl 2-[4,6-bis(sulfanylidene)-1H-1,3,5-triazin-2-yl]-2-methyl-3-oxobutanoate

ethyl 2-[4,6-bis(sulfanylidene)-1H-1,3,5-triazin-2-yl]-2-methyl-3-oxobutanoate structure

CAS No:
6958-50-5
Formula:
C10H13N3O3S2
Chemical Name:
ethyl 2-[4,6-bis(sulfanylidene)-1H-1,3,5-triazin-2-yl]-2-methyl-3-oxobutanoate
Synonyms:
s-Triazine-2-aceticacid,a-acetyl-4,6-dimercapto-a-methyl-,ethyl ester (8CI); Ethyl 2-(4,6-dimercapto-1,3,5-triazin-2-yl)-2-methyl-3-oxobutanoate;

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ethyl 2-[4,6-bis(sulfanylidene)-1H-1,3,5-triazin-2-yl]-2-methyl-3-oxobutanoate Basic Attributes

Molecular Weight：

287.35900

Exact Mass：

287.03983363

NSC Number：

64787

Characteristics

PSA：

152.02000

XLogP3：

1.60660

Density：

1.44g/cm3

Boiling Point：

543ºC at 760 mmHg

Flash Point：

282.2ºC

Refractive Index：

1.709

Computed Properties

Molecular Weight:287.4
XLogP3:1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:287.03983363
Monoisotopic Mass:287.03983363
Topological Polar Surface Area:144
Heavy Atom Count:18
Complexity:461
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-[4,6-bis(sulfanylidene)-1H-1,3,5-triazin-2-yl]-2-methyl-3-oxobutanoate

Basic Attributes
Characteristics
Computed Properties
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