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1,2,4-Triazine (>90%)

CAT: 0572-TRC-T290380-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-T290380-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
290-38-0
Synonyms
1,2,5-Triazine; as-Triazine
Hazard Statement
Causes skin irritation
Smiles
c1cnncn1
Molecular Formula
C3H3N3
Molecular Weight
81.08
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

1,2,4-Triazine

1,2,4-triazine is a triazine and a member of 1,2,4-triazines.

CAS Number290-38-0
PubChem CID67520
IUPAC Name1,2,4-triazine
Molecular FormulaC3H3N3
Molecular Weight81.08
XLogP-0.8
Topological Polar Surface Area38.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count6
Formal Charge0
Complexity37
SMILES
C1=CN=NC=N1
InChI
InChI=1S/C3H3N3/c1-2-5-6-3-4-1/h1-3H
InChIKey
FYADHXFMURLYQI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,2,4-Triazine
CAS: 290-38-0
CID: 67520
Formula: C3H3N3
MW: 81.08
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight81.08
XLogP3-0.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass81.032697108
Monoisotopic Mass81.032697108
Topological Polar Surface Area38.7 Ų
Heavy Atom Count6
Formal Charge0
Complexity37
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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