2-(Methylamino)nicotinonitrile - CAS 52583-87-6
Catalog: |
BB027877 |
Product Name: |
2-(Methylamino)nicotinonitrile |
CAS: |
52583-87-6 |
Synonyms: |
2-(methylamino)-3-pyridinecarbonitrile; 2-(methylamino)pyridine-3-carbonitrile |
IUPAC Name: | 2-(methylamino)pyridine-3-carbonitrile |
Description: | 2-(Methylamino)nicotinonitrile (CAS# 52583-87-6) is a useful research chemical. |
Molecular Weight: | 133.15 |
Molecular Formula: | C7H7N3 |
Canonical SMILES: | CNC1=C(C=CC=N1)C#N |
InChI: | InChI=1S/C7H7N3/c1-9-7-6(5-8)3-2-4-10-7/h2-4H,1H3,(H,9,10) |
InChI Key: | AGZQPTBBDDQFKJ-UHFFFAOYSA-N |
Boiling Point: | 287.4 ℃ at 760 mmHg |
Density: | 1.13 g/cm3 |
MDL: | MFCD08689752 |
LogP: | 1.06798 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-11040958-B2 | Triazole antimicrobial derivative, pharmaceutical composition and use thereof | 20170217 |
US-2019038621-A1 | Posaconazole derivative, pharmaceutical composition and use thereof | 20160204 |
CN-107614501-B | Hydroxyl purine compound and application thereof | 20150520 |
EP-3299371-A1 | Hydroxyl purine compounds and use thereof | 20150520 |
TW-201706268-A | Hydroxyl purine compound and application thereof | 20150520 |
Complexity: | 146 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 133.063997236 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 133.063997236 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 48.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Nitrogen Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS