1-Bromo-3-cyclopropylbenzene - CAS 1798-85-2
Catalog: |
BB013610 |
Product Name: |
1-Bromo-3-cyclopropylbenzene |
CAS: |
1798-85-2 |
Synonyms: |
1-bromo-3-cyclopropylbenzene; 1-bromo-3-cyclopropylbenzene |
IUPAC Name: | 1-bromo-3-cyclopropylbenzene |
Description: | 1-Bromo-3-cyclopropylbenzene (CAS# 1798-85-2) is a useful research chemical. |
Molecular Weight: | 197.07 |
Molecular Formula: | C9H9Br |
Canonical SMILES: | C1CC1C2=CC(=CC=C2)Br |
InChI: | InChI=1S/C9H9Br/c10-9-3-1-2-8(6-9)7-4-5-7/h1-3,6-7H,4-5H2 |
InChI Key: | BCBNVQYWODLZSI-UHFFFAOYSA-N |
Boiling Point: | 230 °C at 760 mmHg |
Density: | 1.474 g/cm3 |
MDL: | MFCD01070823 |
LogP: | 3.32650 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021317094-A1 | Aminocyclobutanes as monoacylglycerol lipase modulators | 20200326 |
WO-2021191390-A1 | Azaspirocycles as monoacylglycerol lipase modulators | 20200326 |
US-2021253565-A1 | Monoacylglycerol lipase modulators | 20200210 |
WO-2021105117-A1 | Substituted aminoquinolones as dgkalpha inhibitors for immune activation | 20191128 |
WO-2020221816-A1 | Novel phenyl and pyridyl ureas active against the hepatitis b virus (hbv) | 20190430 |
Complexity: | 118 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 195.98876 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 195.98876 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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