N-(3-Iodo-pyridin-2-yl)-2,2-dimethyl-propionamide - CAS 113975-31-8
Catalog: |
BB003287 |
Product Name: |
N-(3-Iodo-pyridin-2-yl)-2,2-dimethyl-propionamide |
CAS: |
113975-31-8 |
Synonyms: |
N-(3-iodopyridin-2-yl)-2,2-dimethylpropanamide |
IUPAC Name: | N-(3-iodopyridin-2-yl)-2,2-dimethylpropanamide |
Description: | N-(3-Iodo-pyridin-2-yl)-2,2-dimethyl-propionamide (CAS# 113975-31-8) is a useful research chemical. |
Molecular Weight: | 304.13 |
Molecular Formula: | C10H13IN2O |
Canonical SMILES: | CC(C)(C)C(=O)NC1=C(C=CC=N1)I |
InChI: | InChI=1S/C10H13IN2O/c1-10(2,3)9(14)13-8-7(11)5-4-6-12-8/h4-6H,1-3H3,(H,12,13,14) |
InChI Key: | WHHVZQZQGUTYJM-UHFFFAOYSA-N |
Boiling Point: | 402.6 ℃ at 760 mmHg |
Melting Point: | 148.8-149.0 ℃ |
Purity: | 95 % |
Density: | 1.623 g/cm3 |
MDL: | MFCD05662384 |
LogP: | 2.74380 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2016073903-A1 | Use of compositions modulating chromatin structure for graft versus host disease (gvhd) | 20141106 |
JP-2012176900-A | Pyridine derivatives having a ((phosphonooxy) methyl) pyridinium ring and antifungal agents containing them | 20090624 |
US-2010331282-A1 | Pyridine derivative containing ((phosphonooxy)methyl)pyridinium ring, and antifungal agent containing these derivative | 20090624 |
WO-2010150761-A1 | Pyridine derivative having ((phosphonooxy)methyl)pyridinium ring and anti-fungal agent comprising same | 20090624 |
EA-018328-B1 | Novel heterocyclic compounds as mglu5 antagonists | 20070802 |
Complexity: | 213 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 304.00726 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 304.00726 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 42 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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