1-(4-Nitrophenyl)cyclopentane-1-methanamine - CAS 927993-50-8
Catalog: |
BB040640 |
Product Name: |
1-(4-Nitrophenyl)cyclopentane-1-methanamine |
CAS: |
927993-50-8 |
Synonyms: |
[1-(4-nitrophenyl)cyclopentyl]methanamine; [1-(4-nitrophenyl)cyclopentyl]methanamine |
IUPAC Name: | [1-(4-nitrophenyl)cyclopentyl]methanamine |
Description: | 1-(4-Nitrophenyl)cyclopentane-1-methanamine (CAS# 927993-50-8 ) is a useful research chemical. |
Molecular Weight: | 220.27 |
Molecular Formula: | C12H16N2O2 |
Canonical SMILES: | C1CCC(C1)(CN)C2=CC=C(C=C2)[N+](=O)[O-] |
InChI: | InChI=1S/C12H16N2O2/c13-9-12(7-1-2-8-12)10-3-5-11(6-4-10)14(15)16/h3-6H,1-2,7-9,13H2 |
InChI Key: | HMCJRULISANTGR-UHFFFAOYSA-N |
LogP: | 3.58880 |
Complexity: | 248 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 220.121177757 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 220.121177757 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 71.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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