1-(2-Bromoethyl)-1,2,3-triazole - CAS 1083172-01-3
Catalog: |
BB002246 |
Product Name: |
1-(2-Bromoethyl)-1,2,3-triazole |
CAS: |
1083172-01-3 |
Synonyms: |
1-(2-bromoethyl)triazole; 1-(2-bromoethyl)triazole |
IUPAC Name: | 1-(2-bromoethyl)triazole |
Description: | 1-(2-Bromoethyl)-1,2,3-triazole (CAS# 1083172-01-3 ) is a useful research chemical. |
Molecular Weight: | 176.01 |
Molecular Formula: | C4H6BrN3 |
Canonical SMILES: | C1=CN(N=N1)CCBr |
InChI: | InChI=1S/C4H6BrN3/c5-1-3-8-4-2-6-7-8/h2,4H,1,3H2 |
InChI Key: | QWLGWYIJLZUOKP-UHFFFAOYSA-N |
LogP: | 0.67300 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Complexity: | 68.3 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 174.97451 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 174.97451 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 30.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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