2-Amino-3-nitrobenzonitrile - CAS 87331-46-2
Catalog: |
BB074545 |
Product Name: |
2-Amino-3-nitrobenzonitrile |
CAS: |
87331-46-2 |
Synonyms: |
2-AMINO-3-NITROBENZONITRILE; Benzonitrile, 2-amino-3-nitro-; Benzonitrile,2-amino-3-nitro-; 2-amino-3-nitro-benzonitrile |
IUPAC Name: | 2-amino-3-nitrobenzonitrile |
Description: | 2-Amino-3-nitrobenzonitrile |
Molecular Weight: | 163.13 |
Molecular Formula: | C7H5N3O2 |
Canonical SMILES: | C1=CC(=C(C(=C1)[N+](=O)[O-])N)C#N |
InChI: | InChI=1S/C7H5N3O2/c8-4-5-2-1-3-6(7(5)9)10(11)12/h1-3H,9H2 |
InChI Key: | YWLQSBPRLUBYOR-UHFFFAOYSA-N |
Complexity: | 227 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 163.038176411 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 163.038176411 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 95.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Other Building Blocks
Customers Also Viewed
-
[30360-19-1]
N,N'-Diethyl-N''-isopropyl-1,3,5-triazine-2,4,6-triamine
-
[35045-02-4]
Metribuzin-desamino
-
[3886-90-6]
N,N-dimethyloctadecanamide
-
[72607-53-5]
N-(3-Aminopropyl)methacrylamide Hydrochloride
-
[132182-92-4]
Pentane, 1,1,1,2,2,3,4,5,5,5-decafluoro-3-methoxy-4-(trifluoromethyl)-
-
[133407-82-6]
MG-132
INDUSTRY LEADERS TRUST OUR PRODUCTS