1-(4-bromophenyl)piperazine - CAS 66698-28-0
Catalog: |
BB033087 |
Product Name: |
1-(4-bromophenyl)piperazine |
CAS: |
66698-28-0 |
Synonyms: |
1-(4-bromophenyl)piperazine |
IUPAC Name: | 1-(4-bromophenyl)piperazine |
Description: | 1-(4-bromophenyl)piperazine (CAS# 66698-28-0) is a useful research chemical for organic synthesis and other chemical processes. |
Molecular Weight: | 241.13 |
Molecular Formula: | C10H13BrN2 |
Canonical SMILES: | C1CN(CCN1)C2=CC=C(C=C2)Br |
InChI: | InChI=1S/C10H13BrN2/c11-9-1-3-10(4-2-9)13-7-5-12-6-8-13/h1-4,12H,5-8H2 |
InChI Key: | PJHPFAFEJNBIDC-UHFFFAOYSA-N |
Boiling Point: | 353.3 ℃ at 760 mmHg |
Melting Point: | 93-94 ℃ |
Purity: | 98 % |
Density: | 1.386 g/cm3 |
LogP: | 2.25250 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112341396-A | Novel monoacylglycerol esterase inhibitor and preparation method and application thereof | 20201104 |
EP-3875452-A1 | Monoacylglycerol lipase inhibitors | 20200304 |
WO-2021175913-A1 | Monoacylglycerol lipase inhibitors | 20200304 |
CN-112300082-A | Phenyl piperazine quinazoline compound or pharmaceutically acceptable salt thereof, preparation method and application | 20190726 |
WO-2021017996-A1 | Phenylpiperazine quinazoline compound or pharmaceutically acceptable salt thereof, and preparation method therefor and use thereof | 20190726 |
Complexity: | 149 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 240.02621 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 240.02621 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 15.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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