2-(Aminomethyl)-5-nitrobenzofuran - CAS 165735-65-9
Catalog: |
BB012210 |
Product Name: |
2-(Aminomethyl)-5-nitrobenzofuran |
CAS: |
165735-65-9 |
Synonyms: |
(5-nitro-2-benzofuranyl)methanamine; (5-nitro-1-benzofuran-2-yl)methanamine |
IUPAC Name: | (5-nitro-1-benzofuran-2-yl)methanamine |
Description: | 2-(Aminomethyl)-5-nitrobenzofuran (CAS# 165735-65-9 ) is a useful research chemical. |
Molecular Weight: | 192.17 |
Molecular Formula: | C9H8N2O3 |
Canonical SMILES: | C1=CC2=C(C=C1[N+](=O)[O-])C=C(O2)CN |
InChI: | InChI=1S/C9H8N2O3/c10-5-8-4-6-3-7(11(12)13)1-2-9(6)14-8/h1-4H,5,10H2 |
InChI Key: | QTUOOFZAKSGAQH-UHFFFAOYSA-N |
LogP: | 0.00000 |
Publication Number | Title | Priority Date |
US-5872139-A | Heterocyclymethylamino derivatives of cyclobutene-3,4-diones | 19960617 |
Complexity: | 229 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 192.05349212 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 192.05349212 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 85 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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