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Structure

3-Allyl-2-mercapto-5,6,7,8-tetrahydro-3H-benzo[4,5]thieno[2,3-d]pyrimidin-4-one

CAS
42062-91-9
Catalog Number
ACM42062919
Category
Other Products
Molecular Weight
278.39
Molecular Formula
C13H14N2OS2

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Specification

Synonyms
[1]BENZOTHIENO[2,3-D]PYRIMIDIN-4(3H)-ONE, 5,6,7,8-TETRAHYDRO-2-MERCAPTO-3-(2-PROPENYL)-;3-ALLYL-2-SULFANYL-3,4,5,6,7,8-HEXAHYDROBENZO[4,5]THIENO[2,3-B]PYRIDIN-4-ONE;3-ALLYL-2-MERCAPTO-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-4(3H)-ONE;3-ALLYL-2-M
IUPAC Name
3-prop-2-enyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one
Canonical SMILES
C=CCN1C(=O)C2=C(NC1=S)SC3=C2CCCC3
InChI Key
ZDHGJHRONIXYAM-UHFFFAOYSA-N
Boiling Point
467.2ºC at 760 mmHg
Flash Point
236.4ºC
Density
1.38g/cm³
Exact Mass
278.05500
H-Bond Acceptor
1
H-Bond Donor
1
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