1-(3-Bromophenyl)-2-propyn-1-ol - CAS 29805-16-1
Catalog: |
BB020331 |
Product Name: |
1-(3-Bromophenyl)-2-propyn-1-ol |
CAS: |
29805-16-1 |
Synonyms: |
1-(3-bromophenyl)-2-propyn-1-ol; 1-(3-bromophenyl)prop-2-yn-1-ol |
IUPAC Name: | 1-(3-bromophenyl)prop-2-yn-1-ol |
Description: | 1-(3-Bromophenyl)-2-propyn-1-ol (CAS# 29805-16-1 ) is a useful research chemical. |
Molecular Weight: | 211.06 |
Molecular Formula: | C9H7BrO |
Canonical SMILES: | C#CC(C1=CC(=CC=C1)Br)O |
InChI: | InChI=1S/C9H7BrO/c1-2-9(11)7-4-3-5-8(10)6-7/h1,3-6,9,11H |
InChI Key: | VLPLERWMKJHACA-UHFFFAOYSA-N |
LogP: | 2.11570 |
Publication Number | Title | Priority Date |
IL-32834-A | Substituted chrysanthemumates and pesticides containing them | 19680829 |
Complexity: | 170 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 209.96803 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 209.96803 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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