5-(Adamantan-1-ylmethyl)-4-allyl-2,4-dihydro-3h-1,2,4-triazole-3-thione

Name: 5-(Adamantan-1-ylmethyl)-4-allyl-2,4-dihydro-3h-1,2,4-triazole-3-thione
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CAS No. 777879-33-1
Cat. No. CS-0671865
Purity≥98%
MDL No.MFCD04968888

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5-(Adamantan-1-ylmethyl)-4-allyl-2,4-dihydro-3h-1,2,4-triazole-3-thione|CS-0671865

Structure of 777879-33-1

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General Information

CAS No. 777879-33-1
Cat. No. CS-0671865
Purity ≥98%
MDL No. MFCD04968888
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₆H₂₃N₃S
Molecular Weight 289.44
Synonym(s) None
SMILES C=CCN1C(=NNC1=S)CC23CC4CC(C2)CC(C4)C3

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 33.61
LogP 3.88559
H_Acceptors 3
H_Donors 1
Rotatable_Bonds 4

Other Classifications

Building Blocks Skeleton Bridge Rings compounds Adamantane compounds

Building Blocks Skeleton Aromatic heterocycle compounds Triazole compounds

Key Words

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5-(Adamantan-1-ylmethyl)-4-allyl-2,4-dihydro-3h-1,2,4-triazole-3-thione

CAS No. 777879-33-1

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