3-(Methylthio)-1,2,4-triazine - CAS 28735-21-9
Catalog: |
BB043931 |
Product Name: |
3-(Methylthio)-1,2,4-triazine |
CAS: |
28735-21-9 |
Synonyms: |
3-(Methylthio)-as-Triazine; 1,2,4-Triazine, 3-(methylthio)- |
IUPAC Name: | 3-methylsulfanyl-1,2,4-triazine |
Description: | 3-(Methylthio)-1,2,4-triazine (CAS# 28735-21-9 ) is a useful research chemical. |
Molecular Weight: | 127.17 |
Molecular Formula: | C4H5N3S |
Canonical SMILES: | CSC1=NC=CN=N1 |
InChI: | InChI=1S/C4H5N3S/c1-8-4-5-2-3-6-7-4/h2-3H,1H3 |
InChI Key: | NFHGWQLAJYTULJ-UHFFFAOYSA-N |
Purity: | 97 % |
MDL: | MFCD00490024 |
GHS Hazard Statement: | H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 68.3 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 127.02041835 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 127.02041835 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 64 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0 |
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