2-Amino-3-chlorobenzyl Alcohol - CAS 61487-25-0
Catalog: |
BB031140 |
Product Name: |
2-Amino-3-chlorobenzyl Alcohol |
CAS: |
61487-25-0 |
Synonyms: |
(2-amino-3-chlorophenyl)methanol; (2-amino-3-chlorophenyl)methanol |
IUPAC Name: | (2-amino-3-chlorophenyl)methanol |
Description: | A useful reactant in the synthesis of CGRP-receptor antagonists and PI3K inhibitors. |
Molecular Weight: | 157.60 |
Molecular Formula: | C7H8ClNO |
Canonical SMILES: | C1=CC(=C(C(=C1)Cl)N)CO |
InChI: | InChI=1S/C7H8ClNO/c8-6-3-1-2-5(4-10)7(6)9/h1-3,10H,4,9H2 |
InChI Key: | XIHOYQMBAUMKCY-UHFFFAOYSA-N |
Boiling Point: | 296.283 °C at 760 mmHg |
Density: | 1.341 g/cm3 |
MDL: | MFCD13193432 |
LogP: | 1.99570 |
Publication Number | Title | Priority Date |
CN-112876470-A | Method for synthesizing quinazolinone compound under nonmetal catalysis without additive | 20191129 |
AU-2011272853-A1 | Heterocyclic compounds and their use as inhibitors of PI3K activity | 20100701 |
CA-2803009-A1 | Heterocyclic compounds and their use as inhibitors of pi3k activity | 20100701 |
EP-2588467-A1 | Heterocyclic compounds and their use as inhibitors of pi3k activity | 20100701 |
US-2013085131-A1 | Heterocyclic compounds and their uses | 20100701 |
Complexity: | 110 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 157.0294416 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 157.0294416 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 46.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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