2-Methylbenzamide oxime - CAS 40312-14-9
Catalog: |
BB024442 |
Product Name: |
2-Methylbenzamide oxime |
CAS: |
40312-14-9 |
Synonyms: |
N'-hydroxy-2-methylbenzenecarboximidamide |
IUPAC Name: | N'-hydroxy-2-methylbenzenecarboximidamide |
Description: | 2-Methylbenzamide oxime (CAS# 40312-14-9) is a useful research chemical. |
Molecular Weight: | 150.18 |
Molecular Formula: | C8H10N2O |
Canonical SMILES: | CC1=CC=CC=C1C(=NO)N |
InChI: | InChI=1S/C8H10N2O/c1-6-4-2-3-5-7(6)8(9)10-11/h2-5,11H,1H3,(H2,9,10) |
InChI Key: | UAKAWWHOQNNATR-UHFFFAOYSA-N |
Boiling Point: | 322.6 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.14 g/cm3 |
Appearance: | A crystalline solid |
MDL: | MFCD00052090 |
LogP: | 1.78980 |
GHS Hazard Statement: | H301 (90.48%): Toxic if swallowed [Danger Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H318 (90.48%): Causes serious eye damage [Danger 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, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2019050525-A1 | Rieske-type oxygenase/reductase targeted drugs for diagnostic and treatment of diseases | 20170814 |
US-2021128498-A1 | Targeted drugs associated with trimethylamine and/or trimethylamine-n-oxide | 20170814 |
EP-3215505-A1 | Piperidinylpyrazolopyrimidinones and their use | 20141103 |
EP-3215505-B1 | Piperidinylpyrazolopyrimidinones and their use | 20141103 |
US-10118930-B2 | Piperidinylpyrazolopyrimidinones and their use | 20141103 |
Complexity: | 156 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 150.079312947 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 150.079312947 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 58.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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