1-(4-Bromophenyl)cyclobutanamine - CAS 1094218-30-0
Catalog: |
BB002460 |
Product Name: |
1-(4-Bromophenyl)cyclobutanamine |
CAS: |
1094218-30-0 |
Synonyms: |
1-(4-bromophenyl)-1-cyclobutanamine; 1-(4-bromophenyl)cyclobutan-1-amine |
IUPAC Name: | 1-(4-bromophenyl)cyclobutan-1-amine |
Description: | 1-(4-Bromophenyl)cyclobutanamine (CAS# 1094218-30-0) is a useful research chemical. |
Molecular Weight: | 226.11 |
Molecular Formula: | C10H12BrN |
Canonical SMILES: | C1CC(C1)(C2=CC=C(C=C2)Br)N |
InChI: | InChI=1S/C10H12BrN/c11-9-4-2-8(3-5-9)10(12)6-1-7-10/h2-5H,1,6-7,12H2 |
InChI Key: | JAINAWVWUDTCFK-UHFFFAOYSA-N |
Storage: | Sealed in dry, 2-8 °C |
MDL: | MFCD09910041 |
LogP: | 3.48730 |
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, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3709986-A1 | Novel substituted biaryl compounds as indoleamine 2,3-dioxygenase (ido) inhibitors | 20171114 |
US-2021317091-A1 | Novel substituted biaryl compounds as indoleamine 2,3-dioxygenase (ido) inhibitors | 20171114 |
WO-2019074747-A1 | NOVEL SUBSTITUTED CYCLOBUTYLBENZENE COMPOUNDS AS INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE (IDO) | 20171009 |
EP-3694502-A1 | Novel substituted cyclobutylbenzene compounds as indoleamine 2,3-dioxygenase (ido) inhibitors | 20171009 |
US-2020277252-A1 | Novel substituted cyclobutylbenzene compounds as indoleamine 2,3-dioxygenase (ido) inhibitors | 20171009 |
Complexity: | 157 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 225.01531 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 225.01531 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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