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2-(BENZYLTHIO)-1,4,5,6-TETRAHYDROPYRIMIDINE

2-(BENZYLTHIO)-1,4,5,6-TETRAHYDROPYRIMIDINE structure

CAS No:
6497-88-7
Formula:
C11H14N2S
Chemical Name:
2-(BENZYLTHIO)-1,4,5,6-TETRAHYDROPYRIMIDINE
Synonyms:
2-(Benzylthio)-1,4,5,6-tetrahydropyrimidine;2-(benzylsulfanyl)-1,4,5,6-tetrahydropyrimidine;Pyrimidine,1,4,5,6-tetrahydro-2-[(phenylmethyl)thio]-;F2147-0306;Maybridge1_003353;2-benzylsulfanyl-1,4,5,6-tetrahydropyrimidine;CHEMBL1624413;SCHEMBL10997977;CTK5C1978;DTXSID60384510

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2-(BENZYLTHIO)-1,4,5,6-TETRAHYDROPYRIMIDINE Basic Attributes

Molecular Weight：

206.30726

Exact Mass：

206.08800

DSSTox ID：

DTXSID60384510

HScode：

2933599090

Characteristics

PSA：

49.7

XLogP3：

2.03350

Density：

1.16±0.1 g/cm3(Predicted)

Melting Point：

79-80 °C

Computed Properties

Molecular Weight:206.31
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:206.08776963
Monoisotopic Mass:206.08776963
Topological Polar Surface Area:49.7
Heavy Atom Count:14
Complexity:198
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(BENZYLTHIO)-1,4,5,6-TETRAHYDROPYRIMIDINE

Basic Attributes
Characteristics
Computed Properties

2-(BENZYLTHIO)-1,4,5,6-TETRAHYDROPYRIMIDINE

SDS

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