3-(3-Amino-4-nitrophenyl)-1-propanol - CAS 849235-84-3
Catalog: |
BB037373 |
Product Name: |
3-(3-Amino-4-nitrophenyl)-1-propanol |
CAS: |
849235-84-3 |
Synonyms: |
3-(3-amino-4-nitrophenyl)-1-propanol; 3-(3-amino-4-nitrophenyl)propan-1-ol |
IUPAC Name: | 3-(3-amino-4-nitrophenyl)propan-1-ol |
Description: | 3-(3-Amino-4-nitrophenyl)-1-propanol (CAS# 849235-84-3 ) is a useful research chemical. |
Molecular Weight: | 196.20 |
Molecular Formula: | C9H12N2O3 |
Canonical SMILES: | C1=CC(=C(C=C1CCCO)N)[N+](=O)[O-] |
InChI: | InChI=1S/C9H12N2O3/c10-8-6-7(2-1-5-12)3-4-9(8)11(13)14/h3-4,6,12H,1-2,5,10H2 |
InChI Key: | HLUABOUHLBVAOZ-UHFFFAOYSA-N |
LogP: | 2.20630 |
Publication Number | Title | Priority Date |
EP-1663953-A1 | Inhibitors of histone deacetylase | 20030924 |
JP-2007506785-A | Inhibitors of histone deacetylase | 20030924 |
JP-2008094847-A | Inhibitors of histone deacetylase | 20030924 |
JP-4809228-B2 | Inhibitors of histone deacetylase | 20030924 |
JP-5127402-B2 | Inhibitors of histone deacetylase | 20030924 |
Complexity: | 193 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.08479225 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.08479225 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 92.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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Related Functional Groups
Amines and Anilines
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