1-(3-Bromopropyl)-1,2,3-triazole - CAS 1645260-78-1
Catalog: |
BB012118 |
Product Name: |
1-(3-Bromopropyl)-1,2,3-triazole |
CAS: |
1645260-78-1 |
Synonyms: |
1-(3-bromopropyl)triazole; 1-(3-bromopropyl)triazole |
IUPAC Name: | 1-(3-bromopropyl)triazole |
Description: | 1-(3-Bromopropyl)-1,2,3-triazole (CAS# 1645260-78-1 ) is a useful research chemical. |
Molecular Weight: | 190.04 |
Molecular Formula: | C5H8BrN3 |
Canonical SMILES: | C1=CN(N=N1)CCCBr |
InChI: | InChI=1S/C5H8BrN3/c6-2-1-4-9-5-3-7-8-9/h3,5H,1-2,4H2 |
InChI Key: | JECFPSKVCCYTMT-UHFFFAOYSA-N |
Complexity: | 78.6 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 188.99016 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 188.99016 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 30.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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