2-Amino-3-bromo-5-chlorobenzyl Alcohol - CAS 1595771-52-0
Catalog: |
BB011547 |
Product Name: |
2-Amino-3-bromo-5-chlorobenzyl Alcohol |
CAS: |
1595771-52-0 |
Synonyms: |
(2-amino-3-bromo-5-chlorophenyl)methanol; (2-amino-3-bromo-5-chlorophenyl)methanol |
IUPAC Name: | (2-amino-3-bromo-5-chlorophenyl)methanol |
Description: | 2-Amino-3-bromo-5-chlorobenzyl Alcohol (CAS# 1595771-52-0 ) is a useful research chemical. |
Molecular Weight: | 236.49 |
Molecular Formula: | C7H7BrClNO |
Canonical SMILES: | C1=C(C=C(C(=C1Br)N)CO)Cl |
InChI: | InChI=1S/C7H7BrClNO/c8-6-2-5(9)1-4(3-11)7(6)10/h1-2,11H,3,10H2 |
InChI Key: | KWUVRMMWUWYHCG-UHFFFAOYSA-N |
LogP: | 2.75820 |
Publication Number | Title | Priority Date |
JP-2019524732-A | Tricyclic heteroaryl substituted quinoline and azaquinoline compounds as PAR4 inhibitors | 20160714 |
JP-2019528247-A | Bicyclic heteroaryl substituted compounds | 20160714 |
KR-20190026906-A | Tricyclic heteroaryl-substituted quinolines and azoquinoline compounds as PAR4 inhibitors | 20160714 |
KR-20190027385-A | Bicyclic heteroaryl substituted compounds | 20160714 |
US-2019292176-A1 | Bicyclic heteroaryl substituted compounds | 20160714 |
Complexity: | 136 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 234.93995 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 234.93995 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 46.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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