2-[1,2,4]Triazolo[1,5-A]pyrimidin-6-ylethanol - CAS 959237-50-4
Catalog: |
BB043292 |
Product Name: |
2-[1,2,4]Triazolo[1,5-A]pyrimidin-6-ylethanol |
CAS: |
959237-50-4 |
Synonyms: |
2-{[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}ethan-1-ol |
IUPAC Name: | 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol |
Description: | 2-[1,2,4]Triazolo[1,5-A]pyrimidin-6-ylethanol (CAS# 959237-50-4 ) is a useful research chemical. |
Molecular Weight: | 164.16 |
Molecular Formula: | C7H8N4O |
Canonical SMILES: | C1=C(C=NC2=NC=NN21)CCO |
InChI: | InChI=1S/C7H8N4O/c12-2-1-6-3-8-7-9-5-10-11(7)4-6/h3-5,12H,1-2H2 |
InChI Key: | QQRXAPDUQYJTJO-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P317, P330, and P501 |
Signal Word: | Warning |
Complexity: | 154 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 164.06981089 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 164.06981089 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 63.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.3 |
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