4-Aminoisoquinoline Hydrochloride - CAS 1423031-91-7
Catalog: |
BB009348 |
Product Name: |
4-Aminoisoquinoline Hydrochloride |
CAS: |
1423031-91-7 |
Synonyms: |
4-isoquinolinamine;hydrochloride; isoquinolin-4-amine;hydrochloride |
IUPAC Name: | isoquinolin-4-amine;hydrochloride |
Description: | 4-Aminoisoquinoline Hydrochloride (CAS# 1423031-91-7) is a useful research chemical. |
Molecular Weight: | 180.63 |
Molecular Formula: | C9H9ClN2 |
Canonical SMILES: | C1=CC=C2C(=C1)C=NC=C2N.Cl |
InChI: | InChI=1S/C9H8N2.ClH/c10-9-6-11-5-7-3-1-2-4-8(7)9;/h1-6H,10H2;1H |
InChI Key: | FTZAXOHFFATABT-UHFFFAOYSA-N |
LogP: | 3.20020 |
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-2762476-A1 | 1,2,4-triazine-6-carboxamide derivative | 20110930 |
US-2014343038-A1 | 1,2,4-triazine-6-carboxamide derivative | 20110930 |
US-9145414-B2 | 1,2,4-triazine-6-carboxamide derivative | 20110930 |
Complexity: | 136 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 180.0454260 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 180.0454260 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 38.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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Quinoline/Isoquinoline
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