3-Heptylthio-4(H)-1,2,4-triazole

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Catalog Number
ACM74682501
Product Name
3-Heptylthio-4(H)-1,2,4-triazole
Structure
Structure
CAS
74682-50-1
Category
Heterocyclic Organic Compound
Synonyms
EINECS 277-966-7, JFD03159, 3-(Heptylthio)-1H-1,2,4-triazole, CID2818234, 74682-50-1
IUPAC Name
5-heptylsulfanyl-1H-1,2,4-triazole
Molecular Weight
199.316380 [g/mol]
Molecular Formula
C9H17N3S
Canonical SMILES
CCCCCCCSC1=NC=NN1
InChI Key
HYYBYDAYENEBIE-UHFFFAOYSA-N
Boiling Point
347ºC at 760 mmHg
Flash Point
163.6ºC
Density
1.07g/cm³
EC Number
277-966-7
Exact Mass
199.11400
H-Bond Acceptor
2
H-Bond Donor
1
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